Charge: -1
Inchi:1S/C20H12/c1-2-8-16-15(7-1)17-9-3-5-13-11-12-14-6-4-10-18(16)20(14)19(13)17/h1-12H/q-1
Electronic States
Energy
(eV)
-768.17180
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.01701 b
(cm-1)
0.01294 c
(cm-1)
0.00735
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.49136
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
-1.76100
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
-0.03267
0.03557
2
0.00000
-0.03267
-0.03557
3
0.00000
0.11391
0.04941
4
0.00000
0.11391
-0.04941
5
0.00000
0.01236
-0.03724
6
0.00000
0.01236
0.03724
7
0.00000
-0.06676
-0.07825
8
0.00000
-0.06676
0.07825
9
0.00000
0.00650
-0.00667
10
0.00000
0.00650
0.00667
11
0.00000
-0.01199
-0.00251
12
0.00000
-0.01199
0.00251
13
0.00000
0.02183
-0.01883
14
0.00000
0.02183
0.01883
15
0.00000
-0.03240
0.02434
16
0.00000
-0.03240
-0.02434
17
0.00000
0.02452
-0.02552
18
0.00000
0.02452
0.02552
19
0.00000
-0.00812
0.02537
20
0.00000
-0.00812
-0.02537
21
0.00000
-0.03544
-0.08394
22
0.00000
-0.03544
0.08394
23
0.00000
-0.13770
-0.07430
24
0.00000
-0.13770
0.07430
25
0.00000
-0.09046
0.03875
26
0.00000
-0.09046
-0.03875
27
0.00000
-0.15412
0.08776
28
0.00000
-0.15412
-0.08776
29
0.00000
0.02322
0.01275
30
0.00000
0.02322
-0.01275
31
0.00000
0.07092
0.07201
32
0.00000
0.07092
-0.07201