MolVis - Molekülvisualisierungen - Fakultät für Chemie und Pharmazie

Molecular Vibrations in 3D

The following vibrations result from quantum chemical calculations using the program package ORCA (by Hans-Ulrich Wagner, München, 29. Apr. 2013).
The input and output of ORCA is managed using the opensource program Gabedit.
The vibration visualisation is produced using the opensource program JSmol.

 

IDNameFormulaStructureModesDegenerations
1

Hydrogen cyanide

HCN

31
3

Trichloromethane (Chloroform)

CHCl3

63
4

Formaldehyde

CH2O

60
5

Bromofluoromethane

CH2BrF

90
6

Dichloromethane

CH2Cl2

90
7

Chloromethane

CH3Cl

63
8

Methane

CH4

43
9

Carbon monoxide

CO

10
10

Carbon dioxide

CO2

31
11

Tetrachloromethane

CCl4

43
12

Ethin (Acetylene)

C2H2

52
13

Ethene (Ethylene)

C2H4

120
14

Hydrogen

H2

10
15

Water

H2O

30
16

Ammonia

NH3

42
17

Chlorine

Cl2

10
18

Sulfur hexafluoride

SF6

65
19

Nitrogen

N2

10
20

Ethane

C2H6

126