Charge: -1
Inchi:1S/C12H8/c1-3-9-4-2-6-11-8-7-10(5-1)12(9)11/h1-8H/q-1
Electronic States
Energy
(eV)
-461.49413
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.05061 b
(cm-1)
0.03995 c
(cm-1)
0.02232
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.29247
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
-0.26200
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.04897
0.00000
0.00000
2
0.03873
0.00000
0.00000
3
-0.01356
0.00000
0.04053
4
-0.01356
0.00000
-0.04053
5
0.02397
0.00000
0.03185
6
0.02397
0.00000
-0.03185
7
-0.01751
0.00000
0.03115
8
-0.01751
0.00000
-0.03115
9
-0.02512
0.00000
-0.06035
10
-0.02512
0.00000
0.06035
11
-0.01040
0.00000
0.00706
12
-0.01040
0.00000
-0.00706
13
0.17566
0.00000
0.04398
14
0.17566
0.00000
-0.04398
15
-0.11990
0.00000
0.20709
16
-0.11990
0.00000
-0.20709
17
-0.21997
0.00000
-0.43422
18
-0.21997
0.00000
0.43422
19
0.14957
0.00000
0.12210
20
0.14957
0.00000
-0.12210