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)
0.30100
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.00429
2
0.00000
0.00000
0.00622
3
-0.00180
0.00000
0.02380
4
0.00180
0.00000
0.02380
5
-0.00018
0.00000
-0.01311
6
0.00018
0.00000
-0.01311
7
0.01192
0.00000
0.00574
8
-0.01192
0.00000
0.00574
9
0.01602
0.00000
-0.01859
10
-0.01602
0.00000
-0.01859
11
0.17534
0.00000
-0.00819
12
-0.17534
0.00000
-0.00819
13
-0.04535
0.00000
-0.01611
14
0.04535
0.00000
-0.01611
15
0.02080
0.00000
-0.00766
16
-0.02080
0.00000
-0.00766
17
0.01983
0.00000
-0.01724
18
-0.01983
0.00000
-0.01724
19
0.22549
0.01523
0.05080
20
0.22549
-0.01523
0.05080
21
-0.22549
0.01523
0.05080
22
-0.22549
-0.01523
0.05080