Charge: 0
Inchi:1S/C14H10/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h1-10H
Electronic States
Energy
(eV)
-538.83499
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
D2h
Symmetry Elements
E
C2(z)
C2(y)
C2(x)
i
sigmah(xy)
sigmah(xz)
sigmah(yz)
Rotational Constants
(cm-1)
0.07163 b
(cm-1)
0.01506 c
(cm-1)
0.01244
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
-0.43100
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.00991
0.00000
0.00000
2
-0.00991
0.00000
0.00000
3
0.00208
0.05483
0.00000
4
0.00208
-0.05483
0.00000
5
0.00208
0.05483
0.00000
6
0.00208
-0.05483
0.00000
7
-0.02201
-0.09342
0.00000
8
-0.02201
0.09342
0.00000
9
-0.02201
-0.09342
0.00000
10
-0.02201
0.09342
0.00000
11
0.03743
0.07003
0.00000
12
0.03743
-0.07003
0.00000
13
0.03743
0.07003
0.00000
14
0.03743
-0.07003
0.00000
15
-0.01404
0.00000
0.00000
16
-0.01404
0.00000
0.00000
17
-0.02855
0.11393
0.00000
18
-0.02855
-0.11393
0.00000
19
-0.02855
0.11394
0.00000
20
-0.02855
-0.11394
0.00000
21
-0.11377
-0.00634
0.00000
22
-0.11377
0.00633
0.00000
23
-0.11377
-0.00633
0.00000
24
-0.11377
0.00633
0.00000