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)
-460.74533
Description
T0
Multiplicity
3
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.05095 b
(cm-1)
0.03935 c
(cm-1)
0.02220
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.10117
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)
2.12900
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.06739
2
0.00000
0.00000
-0.06531
3
0.00818
0.00000
-0.03210
4
-0.00818
0.00000
-0.03210
5
-0.03921
0.00000
0.10410
6
0.03921
0.00000
0.10410
7
-0.00803
0.00000
-0.06875
8
0.00803
0.00000
-0.06875
9
0.06187
0.00000
0.01828
10
-0.06187
0.00000
0.01828
11
0.00750
0.00000
0.05482
12
-0.00750
0.00000
0.05482
13
-0.23405
0.00000
0.12677
14
0.23405
0.00000
0.12677
15
-0.07544
0.00000
-0.19064
16
0.07544
0.00000
-0.19064
17
0.12656
0.00000
-0.09144
18
-0.12656
0.00000
-0.09144
19
0.04060
0.00000
0.03631
20
-0.04060
0.00000
0.03631