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)
-539.57243
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)
0.07136 b
(cm-1)
0.01501 c
(cm-1)
0.01240
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)
0.00000
Diff mu Y
(Debye)
-1.17700
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
0.00001
0.00000
2
0.00000
0.00001
0.00000
3
-0.00012
0.00074
0.00000
4
0.00012
0.00074
0.00000
5
-0.00012
0.00074
0.00000
6
0.00012
0.00074
0.00000
7
0.01790
0.00207
0.00000
8
-0.01790
0.00207
0.00000
9
0.01790
0.00207
0.00000
10
-0.01790
0.00207
0.00000
11
0.01934
-0.03434
0.00000
12
-0.01934
-0.03434
0.00000
13
0.01934
-0.03434
0.00000
14
-0.01934
-0.03434
0.00000
15
-0.00001
-0.00132
0.00000
16
-0.00001
-0.00132
0.00000
17
-0.19146
-0.00205
0.00000
18
0.19143
-0.00205
0.00000
19
-0.19145
-0.00205
0.00000
20
0.19141
-0.00205
0.00000
21
-0.21464
0.37814
0.00000
22
0.21463
0.37811
0.00000
23
-0.21463
0.37812
0.00000
24
0.21462
0.37809
0.00000