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)
1.23900
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.00991
2
0.00000
0.00000
0.01468
3
-0.01972
0.00000
-0.01508
4
0.01972
0.00000
-0.01508
5
-0.01971
0.00000
-0.01280
6
0.01971
0.00000
-0.01280
7
-0.00036
0.00000
-0.00141
8
0.00036
0.00000
-0.00141
9
0.01733
0.00000
0.01754
10
-0.01733
0.00000
0.01754
11
0.02458
0.00000
-0.04299
12
-0.02458
0.00000
-0.04299
13
0.05991
0.00000
-0.00968
14
-0.05991
0.00000
-0.00968
15
0.02479
0.00000
-0.04544
16
-0.02479
0.00000
-0.04544
17
-0.01495
0.00000
-0.04657
18
0.01495
0.00000
-0.04657
19
-0.20453
0.28917
0.30350
20
-0.20453
-0.28917
0.30350
21
0.20453
0.28917
0.30350
22
0.20453
-0.28917
0.30350