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)
0.29600
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
0.06963
-0.03605
2
0.00000
0.06963
0.03605
3
0.00000
-0.00547
-0.08773
4
0.00000
-0.00547
0.08773
5
0.00000
0.02441
0.00132
6
0.00000
0.02441
-0.00132
7
0.00000
-0.07090
-0.05767
8
0.00000
-0.07090
0.05767
9
0.00000
0.00133
-0.01440
10
0.00000
0.00133
0.01440
11
0.00000
-0.01522
-0.01523
12
0.00000
-0.01522
0.01523
13
0.00000
0.00722
0.06172
14
0.00000
0.00722
-0.06172
15
0.00000
-0.06408
0.02909
16
0.00000
-0.06408
-0.02909
17
0.00000
-0.00703
-0.03251
18
0.00000
-0.00703
0.03251
19
0.00000
0.05530
-0.05561
20
0.00000
0.05530
0.05561
21
0.00000
-0.06317
0.00116
22
0.00000
-0.06317
-0.00116
23
0.00000
0.07027
0.03808
24
0.00000
0.07027
-0.03808
25
0.00000
0.02233
0.05215
26
0.00000
0.02233
-0.05215
27
0.00000
0.01178
-0.01971
28
0.00000
0.01178
0.01971
29
0.00000
-0.00597
0.07084
30
0.00000
-0.00597
-0.07084
31
0.00000
0.02216
-0.07299
32
0.00000
0.02216
0.07299