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μ†.“° ›°¬¸”°˜ ª°š»¯¢»¯¹ ¥˜½Ð¹ ¸‰³à ›»¯‰Ü¾²á ¥°«±§œ μ£¯•»³à 2009-2010 °-±¥°¶¤¯•°‰¸ (G-Periodic) ‰¯Þ»¹ (Kalzium) μ‰¹ “³à (Chemtool) ¦¯¸¶£¯à (Rasmol)

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Page 1: µ†.“° ›°¬¸”°˜ ª°š»¯¢»¯ ¹ Module-11.6.09...Kalzium ¯§‰Ì°µ§ sidebar, tableview, standard menubar, statusbar ... CAS (Chemical Abstract Service), Old IUPAC

µ†.“° �›°¬¸”°˜ ª°š»¯¢»¯−¹

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−¸‰³à �›»¯�‰Ü¾²á �¥°«±§œ µ£¯•»³à

2009-2010

�°-�±¥°¶¤¯•°‰¸ (G-Periodic)

‰¯Þ−»¹ (Kalzium) µ‰¹ “³à (Chemtool) ¦¯−¸¶£¯à (Rasmol)

Page 2: µ†.“° ›°¬¸”°˜ ª°š»¯¢»¯ ¹ Module-11.6.09...Kalzium ¯§‰Ì°µ§ sidebar, tableview, standard menubar, statusbar ... CAS (Chemical Abstract Service), Old IUPAC

Module Prepared by: Suresh Babu.K, SPO, Thiruvananthapuram

Santhosh.V, MTC, Cherthala

Sakthidharan.P.P, MT, Kannur

Rajesh.K.O, MTC, Kuttanadu

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Page 4: µ†.“° ›°¬¸”°˜ ª°š»¯¢»¯ ¹ Module-11.6.09...Kalzium ¯§‰Ì°µ§ sidebar, tableview, standard menubar, statusbar ... CAS (Chemical Abstract Service), Old IUPAC

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Page 8: µ†.“° ›°¬¸”°˜ ª°š»¯¢»¯ ¹ Module-11.6.09...Kalzium ¯§‰Ì°µ§ sidebar, tableview, standard menubar, statusbar ... CAS (Chemical Abstract Service), Old IUPAC

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Page 10: µ†.“° ›°¬¸”°˜ ª°š»¯¢»¯ ¹ Module-11.6.09...Kalzium ¯§‰Ì°µ§ sidebar, tableview, standard menubar, statusbar ... CAS (Chemical Abstract Service), Old IUPAC

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Page 11: µ†.“° ›°¬¸”°˜ ª°š»¯¢»¯ ¹ Module-11.6.09...Kalzium ¯§‰Ì°µ§ sidebar, tableview, standard menubar, statusbar ... CAS (Chemical Abstract Service), Old IUPAC

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Page 12: µ†.“° ›°¬¸”°˜ ª°š»¯¢»¯ ¹ Module-11.6.09...Kalzium ¯§‰Ì°µ§ sidebar, tableview, standard menubar, statusbar ... CAS (Chemical Abstract Service), Old IUPAC

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˜Ó¯½˜¯¢¯¥¹ œ°Üˤ°¶¾Ê ˜Ó¯½˜¤²µ“ ¥¯−ª¯‰»¹ µµ“Ô¸ µü¤¸˜¸

18

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textbox-œ¸ ª§˜²ª«Ì²á calc †Ò ¡È—°Þ ¿°¾¸ µüÛ²‰.

−àý»³¥°¾¯−°•°µú ˜Ó¯½˜¯ ¢¯¥¹ œ°Üˤ°¾²Ò˜°œ¸ H2SO4 †Ò¸

µµ“Ô¸ µü¤¸˜¸ calc †Ò ¡È—°Þ ¿°¾¸ µü¤¸˜¯Þ £˜°¤¯‰²¹.

‰¯Þ−»¹ �¯§‰¹

½�ªÜÌœ¹ - 7

• HNO3 • C24H42O21

• C12H22O11 • CH3(CH2)2 COOH

• Ca3(PO4)2 • Na3AlF6

£²‰¨°Þ œÞ‰°¤°¥°¾²Ò ˜Ó¯½˜‰¨²µ“ ¢¯¥¹ œ°Üˤ°¾²‰.

Timeline

ˆ¯¶¥¯ ‰¯§ŒÈÌ°§²¹ ‰µÊÌ°¤ £³§‰Äà ‡µ˜ß¯µ£Ò¸

£œæ°§¯¾²Ò˜°œ¯¤° timeline „�¶¤¯‹°¾¯¹. sidebar-µ§ timeline-Þ ¿°¾¸

µü¤¸˜¶«¬¹ year †Ò˜°œ²˜¯µ©¤²á slider œ±¾° ªÜ¬¹ ½‰£±‰¥°¾²‰.

Slider œ±¾²Ò˜°œœ²−¥°Å¸ table view-Þ „ʯ‰²Ò £¯Ý¹ ˜°¥°Å¦°¤²‰.

19

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‰¯Þ−»¹ �¯§‰¹

½�ªÜÌœ¹ - 8

1800 ªµ¥ ‰µÊÌ°¤ £³§‰Ä¨²µ“ ˆ¥² Screenshot †“²Ì¸

œ°Ä¨²µ“ ¶ý¯à•¦°Þ −³À°¾²‰.

„·¬¸£¯ª¸ ª»˜°¤¯œª²¹ £³§‰Ä¨²µ“ �ªð¤²¹

3630K „·¬¸£¯ª°Þ Š¥¯ªð¤°Þ ð°˜°µüÛ²Ò £³§‰Äà

‡µ˜ß¯¹? ª¯˜‰¯ªð¤°Þ ð°˜°µüÛ²Òª ‡µ˜ß¯¹? ˜²“Ä°¤ª

‰µÊ̲Ҙ°œ²¹ Kalzium „�¶¤¯‹°¾¯¹. Sidebar-µ§ State of matter

†Ò˜°Þ ¿°¾¸ µüÛ²‰. Temperature †Ò˜°œ¸ ˜¯µ© 3630 †Ò¸ µµ“Ô¸

µü¤¸˜¸ Enter ‰± �£Ü̲‰. �¶Ô¯à š´«»£¯‰²Ò Table view-Þ

Š¥¯ªð¤°§²á £³§‰Äà ‰µÊ̲‰. Slider œ±¾°¤²¹ „·¬¸£¯ª¸

ª»˜»¯−µÔ“²Ì¯ª²Ò˜¯—¸.

20

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‰¯Þ−»¹ �¯§‰¹

½�ªÜÌœ¹ - 9

2000K-Þ „·¬¸£¯¤°Þ £³§‰Ä¨²µ“ �ªð ½�šÜ«°Ô°¾²Ò Kalzium

�¯§‰Ì°µú Scree Shot ˜Û¯¦¯¾° œ°Ä¨²µ“ ¶ý¯à•¦°Þ −³À°¾²‰.

¥¯−−£ª¯‰»¹ −£±‰¥°¾¯¹

H2 + I2 ---> HI †Ò ¥¯−−£ª¯‰»¹ −£±‰¥°¾²Ò˜°œ¸

½�¤¯−£²Ê¯ª°ß, �µß! †Ò¯Þ,

Cu + HNO3 ---> CU(NO3)2 + NO + H2O †Ò −£ª¯‰»£¯¤¯Þ �ÞÔ¹

½�¤¯−¹ ¶œ¥°“¯¹. ‡µ˜¯¥² ¥¯−−£ª¯‰»µÌ¤²¹ −£±‰¥°¾²Ò˜°œ¸

Kalzium „�¶¤¯‹°¾¯¹. ƒ˜°œ¯¤° Tools µ£œ²ª°µ§ Equation solver-Þ ¿°¾¸

µü¤¸˜¸ '' †Ò �“¤¯¨Ì°µú ª§˜¸ ¢¯‹Ì¸ −£ª¯‰»¹ µµ“Ô¸µü¤¸˜¸

Apply ¡ÈÉ �£Ü̲‰. −£ª¯‰»¹ µµ“Ô¸ µüÛ²¶Ø¯à ˆ¯¶¥¯

˜Ó¯½˜²¤²µ“¤²¹ ƒ“˜¸ ¢¯‹Ì¸ −¹Š»¤¸¾¸ �‰¥¹ a, b, c, d ... ˜²“Ä°¤

ü¥Äà „àµÔ“²Ì—¹. '--->' �“¤¯¨µÌ '--'„¹ '>' ü°®¸œª²¹ „�¶¤¯‹°Å¸

−³ü°Ô°¾¯¹.

„š¯: aCu + bHNO3 ---> cCu (NO3)2 + dNO + CH2O

21

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‰¯Þ−»¹ �¯§‰¹

½�ªÜÌœ¹ - 10

ü²ªµ“ œÞ‰°¤°¥°¾²Ò −£ª¯‰»Äà Kalzium „�¶¤¯‹°Å¸

−£±‰¥°Å¶«¬¹ ƒªµ¤ß¯¹ ½�šÜ«°Ô°¾²Ò �¯§‰Ì°µú ˆ¥² Screen Shot,

œ°Ä¨²µ“ ¶ý¯à•¦°Þ −³À°¾²‰.

• CH4 + C2H6 + O2 + HNO3 ---> H2O + CO2 + NO2

• CH3 (CH2)3 COoH + O2 ---> H2O + CO2

• C24H42O21 + H2O ---> C6H12O6

• Fe[2+] + MnO4[-] + H3O

[+] ---> Mn[2+] + H2O + Fe[3+]

½‹¯ý²‰à ª¥¤¸¾¯¹

½‹¯ý²‰à ˜Û¯¦¯¾²Ò˜°œ¯¤° tools menu-ª°µ§ plotdata-¤°Þ ¿°¾¸

µü¤¸˜¸ š´«»£¯‰²Ò �¯§‰Ì°µ§ Y-axis †Ò˜°œ¸ ˜¯µ©¤²á '∇ '

ü°®¸œÌ°Þ ¿°¾¸ µü¤¸˜¸ mass, Electronegativity †Ò°ª¤°Þ

‡µ˜Ã°§²µ£¯Ò¸ ˜°¥µÇ“²¾²‰. �˜°œ²¶«¬¹ Connect points †Ò

checkbox-Þ ¿°¾¸ µü¤¸˜¸ First element, Last element †Ò˜°Þ ‚ª«»£¯¤

−¹Š»‰à œÞ‰° plot †Ò ¡È—°Þ ¿°¾¸ µü¤¸˜¯Þ £˜°.

22

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‰¯Þ−»¹ �¯§‰¹

½�ªÜÌœ¹ - 11

3-¯¹ �±¥±•°µ§ £³§‰Ä¨²µ“ Electro negativity, Mass, Melting point

˜²“Ä°¤ª¤²µ“ ª»˜»¯−¹ ½�šÜ«°Ô°¾²Ò ½‹¯ý¸ ˜Û¯¦¯¾²‰.

Glossary and Tools

Tools ---> Glossary ---> Knowledge/Tools †Ò¸ ¿°¾¸ µüÛ²¶Ø¯à

§¢»£¯‰²Ò �¯§‰Ì°Þ œ°¥ª›° �šÄ¨²µ“ ª°«š±‰¥—ª²¹, ü°½˜Ä¨²¹

„àµÔ“²Ì°¤°¥°¾²Ò². Covalent radius, Vander Waal's radius, isobar

˜²“Ä°¤ �šÄ¨²µ“ ª°«š±‰¥—ª²¹ Water Jet Pump, Mortar ˜²“Ä°¤

œ°¥ª›° ª−¸˜²¾¨²µ“ ü°½˜ª²¹ ƒ˜°Þ „àµÔ“²Ì°¤°È²Ê¸.

‰¯Þ−»¹ �¯§‰¹

23

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Kalzium −¶Ã˜Ì°¶ú œ°¥ª›°¤¯¤ ½�¶˜»‰˜‰à

˜°¥°Å¦°Ç²ªµß¯? ‡µ˜ß¯¹ �¯”¢¯‹Äà �”°Ô°¾²Ò˜°œ¸ ƒª

½�¶¤¯�œµÔ“²Ì¯µ£Ò¸ üÜÅ µüÛ²‰.

Rasmol

ª°ª°› ˜Ó¯½˜‰¨²µ“ ½˜°£¯œ ü°½˜Äà ‰¯—²Ò˜°œ²¹ ª°«‰§œ¹

µüÛ²Ò˜°œ²¹ −®¯¤°¾²Ò ˆ¥²¶−¯ý¸“¸µª¤Ü ‚—¸ Rasmol.

˜Ó¯½˜µ¤¾²¦°Å¸ �“°ð¯œ ª°ª¥Ä¨“Ä°¤ ý¤Þ ƒÏ�²È¯¤°

−¼±‰¥°Å¶«¬¹ ª°ª°› ªÜËĨ²µ“ −®¯¤¶Ì¯µ“ £¶œ¯®¥£¯¤° �˜¸

−¸½‰±œ°Þ ½�šÜ«°Ô°¾²Ò². �§ ¶ý¯Ü£¯Ý°§²á input File-Þ

„�¶¤¯‹°¾¯ª²Ò˜¯—¸. −¯›¯¥— „�¶¤¯‹°¾²Ò ˆ¥² format ‚—¸ PDB

(Protene Data Bank).

Rasmol Open µüÛ²Ò ª°›¹

Application --> Education ---> Rasmol Molecular Graphics.Visualization.

Rasmol-Þ ¿°¾¸ µü¤¸˜¯Þ ¥Ê¸ ª°Ï¶•¯‰à š´«»£¯‰²Ò² (ü°½˜¹

Ras 1.jpg). ˆÒ¸ Graphics or Canvas Window¤²¹ ¥Ê¯£¶Ì˜¸ Command line

or terminal window

ü°½˜¹ Ras.1.jpg

24

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Rasmol „�¶¤¯‹°Å¸ ethanol-µú Œ“œ ‰¯—²Ò ¥±˜°¤¯—¸ ˜¯µ©

½�˜°�¯š°Å°¥°¾²Ò˜¸. ƒ˜°œ¯¤° ethanol.PDB file CD-¤°Þ œ°Ò¸ home-¶§¾¸

¶‰¯Ô°µüÛ²‰. ‰³“²˜Þ pdb ý¤§²‰à ‰µÊ̲Ҙ°œ²¶ªÊ°

ftp://ftp.wwpdb.org/pub/pdb/data/ †Ò µª¡¸µµ−ݸ ‰¯—²‰.

1. Rasmol Molecular Graphics Visualization ˜²¦¾²‰.

ü°½˜¹ Ras.2.jpg

2. Canvas window-¤°Þ File-->Open-->(Ras.2n) ½‰£Ì°Þ (ü°½˜¹

Ras 2.jpg) ¿°¾¸ µüÛ²¶Ø¯à µ“Ü£°œÞ ª°Ï¶•¯¤°Þ ý¤Þ

µœ¤°¹ ‚ª«»µÔ“²Ò˜¸ ‰¯—¯¹.

3. Terminal window-¤°Þ ý¤Þ µœ¤°¹ (ethanol.PDB) µµ“Ô¸ µü¤¸˜¸

†úÜ �£Ü̲‰. (ü°½˜¹ Ras3.jpg) (Canvas window-¤°Þ ethane-

µú wireframe £¯˜´‰ š´«»£¯‰²Ò²)(ü°½˜¹ Ras 4.jpg)

25

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ü°½˜¹ Ras.3.jpg

ü°½˜¹ Ras.4.jpg

4. ƒ˜°œ¸ œ£²¾¸ �¥°ü°˜£¯¤ Ball and Stick µµèÞ œÞ‰²Ò˜°œ¸

Canvas window-¤°Þ Display ---> Ball & Stick ½‰£Ì°Þ ¿°¾¸

µüÛ²‰ (ü°½˜¹ Ras 5.jpg)

26

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ü°½˜¹ Ras.5.jpg

Ethane µú Ball and Stick £¯˜´‰ š´«»£¯‰²Ò². (ü°½˜¹ Ras 6.jpg)

ü°½˜¹ Ras.6.jpg

ƒ˜¸ œ£²¾¸ †Äµœµ¤¯µ¾ µ£ÅµÔ“²Ì¯¹ †Ò² ¶œ¯¾¯¹.

27

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1. ˜Ó¯½˜µ¤ x �ÀÌ°§²¹ Y �ÀÌ°§²¹ ‰¦¾²Ò˜°œ¸ £·−¸ X

�ÀÌ°§²¹ Y �ÀÌ°§²¹ ½•¯‹¸ µüÛ²‰ or scroll bar

„�¶¤¯‹°¾²‰.

2. ª»˜»ð £¯˜´‰‰¨°Þ Display µüÛ²Ò˜°œ¸

Display ---> ‚ª«»£²á £¯˜´‰ µ˜¥µÇ“²¾²‰.

3. ª°ª°› œ°¦Äà œÞ‰²Ò˜°œ¸ colours --> ‚ª«»£²á mode

µ˜¥µÇ“²¾²‰.

4. ˜Ó¯½˜‰à Label µüÛ²Ò˜°œ²¹ settings---> Pick Label ¿°¾¸

µüÛ²‰. ¶«¬¹ Label µü¶ÛÊ ‚ÝÌ°Þ ¿°¾¸ µüÛ²‰.

5. ˜Ó¯½˜‰à ˜Ù°§²á ¶‰¯É �¨¾²Ò˜°œ²¹ �‰§¹

‰¯—²Ò˜°œ²¹

Settings ---> Pick Angle ¿°¾¸ µüÛ²‰.

Settings ---> Pick distance

¶«¬¹ �ÝĨ°Þ ¿°¾¸ µüÛ²‰.

6. Exports µüÛ²Ò˜°œ¸ (PPM format-Þ)

Export -- PPM (terminal window-Þ file name œÞ‰²‰.

£Ý² ¶ý¯Ü£¯Ý²‰¨°Þ µüÛ²Ò˜°œ¸ ‚ ƒœ¹ µ−§‰¸“¸ µü¤¸˜¯Þ

£˜°.

7. File save µüÛ²Ò˜°œ¸

File ---> Save as (terminal window-Þ file name œÞ‰²‰)

8. File ¶¿¯−¸ µüÛ²Ò˜°œ¸

File ---> Close.

Display Window¤²µ“ Back ground colour £¯Ý²Ò˜°œ¸

28

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Terminal window-Þ

background < colour> †Ò ½‰£Ì°Þ command œÞ‰²‰

Colour œÞ‰²Ò˜°œ¸ Colour name ª¶Å¯ Colour code ª¶Å¯ ‚ª¯¹

eg: background Blue or

background (0,0,255)

Text Size £¯Ý²Ò˜°œ¸

Terminal window-Þ

Set fontsize <Size>

eg: Set fontsize 12

Fonrt stroke £¯Ý²Ò˜°œ¸

Terminal window-Þ

Set fontstroke <num>

eg: Set fontstroke 1

‚ÝÌ°ú œ°¦¹ £¯Ý²Ò˜°œ¸

‚ÝÌ°µú œ°¦¹ £¯Ý²Ò˜°œ¸ ¥Ê²ŒÈĨ²Ê¸. ˆÒ¸ ‚ݹ µ−§‰¸“¸

µüÛ²‰. ¥Ê¸ µ−§‰¸“¸ µü¤¸˜ ‚ÝĨ²µ“ œ°¦¹ £¯¦²‰.

„š¯: †Ì¶œ¯¨°µ§ ‰¯Ü¡É ‚ÝĨ²µ“ œ°¦¹ œ±§¤¯¾° £¯Ý—

µ£Ò°¥°¾µÈ.

Terminal window-Þ ˜¯µ©Ô¦¤²Ò Command‰à œÞ‰²‰

1. Select carbon

2. Colour blue or colour (0,0,255)

½�ªÜÌœÄà

29

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1. ˜¯µ©Ô¦¤²Ò ˜Ó¯½˜‰à PPM format-Þ export µüÛ²‰.

a. Diamond, graphite, fallerine

2. ˜Ó¯½˜¤°µ§ H.O ‚ÝÄà ˜Ù°§²á �‰§¹ ª»ø£¯¾²Ò

¥±˜°¤°Þ ˆ¥² Screen shot œ°ÜÙ°¾²‰.

3. Methane ˜Ó¯½˜¤°Þ Carbone-œ¸ ü²ªÔ¸ œ°¦ª²¹ Hydrogen-œ¸

œ±§œ°¦ª²¹ œÞ‰²‰. ü°½˜Ì°µú Screen shot œ°ÜÙ°¾²‰.

4. Ethane ˜Ó¯½˜µ¤ ª°ª°› ¥±˜°¤Þ ‰¦¾° ˆ¯¶¥¯Ò°µú¤²¹ screenshot

†“²¾²‰.

Rasmol Installation

1. CD-¤°Þ „á rasmol_2.7.2.1.1-5.i386.deb file home-¶§¾¸ ¶‰¯Ô°

µüÛ²‰.

2. File-¶§¾¸ µµ¦Ý¸ ¿°¾¸ µü¤¸˜˜°œ² ¶«¬¹ Open with "GDebi

package installer" item µ−§‰¸“¸ µüÛ²‰.

3. ˜²¦Ò²ªÒ package installer ª°Ï¶•¯¤°Þ Install Package button

¿°¾¸ µüÛ²‰.

OR

Root Terminal window-¤°Þ ˜¯µ©Ô¦¤²Ò command run µüÛ²‰.

dpkg -i rasmol_2.7.2.1.1-5_i386.deb

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Kalzium

I Std. VIII

1. Chapter - 5 - Molecular Atom

2. Chapter - 6 - Chemical bonding

3. Chapter - 7 - Stability

II Std. IX

1. Chapter - 1 - Periodic table

2. Chapter - 2 - Chemical bonding

3. Chapter - 5 - Carbob - Equation balancing

4. Chapter - 7 - Non-metals

5. Chapter - 8 - Metals

III Std. X

1. Chapter - 1 - Language of chemistry

2. Chapter - 2 - Structure of atom and periodic table

3. Chapter - 7 - Organic compounds chemical reaction

- Equation balancing

4. Chapter - 10 - Acids - Equation balancing

***************

31