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)
-768.42040
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.01688 b
(cm-1)
0.01288 c
(cm-1)
0.00730
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.55919
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
-0.13800
Eigenvectors
#
X
Y
Z
1
0.00000
-0.01189
0.06071
2
0.00000
0.01189
0.06071
3
0.00000
-0.06760
0.01590
4
0.00000
0.06760
0.01590
5
0.00000
0.00191
0.06007
6
0.00000
-0.00191
0.06007
7
0.00000
-0.01365
-0.01335
8
0.00000
0.01365
-0.01335
9
0.00000
0.00542
0.07388
10
0.00000
-0.00542
0.07388
11
0.00000
-0.08724
-0.04266
12
0.00000
0.08724
-0.04266
13
0.00000
0.00132
-0.02921
14
0.00000
-0.00132
-0.02921
15
0.00000
-0.05922
-0.06907
16
0.00000
0.05922
-0.06907
17
0.00000
-0.00276
-0.01729
18
0.00000
0.00276
-0.01729
19
0.00000
0.00059
-0.02093
20
0.00000
-0.00059
-0.02093
21
0.00000
-0.05899
-0.11185
22
0.00000
0.05899
-0.11185
23
0.00000
-0.11961
-0.06143
24
0.00000
0.11961
-0.06143
25
0.00000
0.07284
-0.06943
26
0.00000
-0.07284
-0.06943
27
0.00000
0.00737
0.07245
28
0.00000
-0.00737
0.07245
29
0.00000
-0.00377
-0.02554
30
0.00000
0.00377
-0.02554
31
0.00000
0.00352
-0.01917
32
0.00000
-0.00352
-0.01917