Charge: 1
Inchi:1S/C12H10/c1-3-9-4-2-6-11-8-7-10(5-1)12(9)11/h1-6H,7-8H2/q+1
Electronic States
Energy
(eV)
-462.45186
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.04727 b
(cm-1)
0.03942 c
(cm-1)
0.02167
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.01975
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)
-0.58300
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.03295
2
0.00000
0.00000
0.02478
3
0.01119
0.00000
-0.05370
4
-0.01119
0.00000
-0.05370
5
-0.02248
0.00000
-0.01240
6
0.02248
0.00000
-0.01240
7
0.00822
0.00000
-0.03064
8
-0.00822
0.00000
-0.03064
9
0.01171
0.00000
0.05577
10
-0.01171
0.00000
0.05577
11
0.01501
0.00000
0.03150
12
-0.01501
0.00000
0.03150
13
-0.25965
0.00000
-0.02805
14
0.25965
0.00000
-0.02805
15
0.12569
0.00000
-0.23002
16
-0.12569
0.00000
-0.23002
17
0.21174
0.00000
0.43900
18
-0.21174
0.00000
0.43900
19
-0.03556
-0.00084
-0.00979
20
-0.03556
0.00084
-0.00979
21
0.03556
-0.00084
-0.00979
22
0.03556
0.00084
-0.00979