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)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
-0.00027
0.00000
2
0.00000
0.00027
0.00000
3
-0.00031
0.00098
0.00000
4
-0.00031
-0.00098
0.00000
5
0.00031
-0.00098
0.00000
6
0.00031
0.00098
0.00000
7
0.02585
0.00155
0.00000
8
0.02585
-0.00155
0.00000
9
-0.02584
-0.00155
0.00000
10
-0.02584
0.00155
0.00000
11
0.01405
-0.03034
0.00000
12
0.01405
0.03034
0.00000
13
-0.01405
0.03033
0.00000
14
-0.01405
-0.03033
0.00000
15
-0.00001
-0.00159
0.00000
16
-0.00001
0.00159
0.00000
17
-0.28658
-0.00120
0.00000
18
-0.28658
0.00120
0.00000
19
0.28648
0.00120
0.00000
20
0.28648
-0.00120
0.00000
21
-0.18348
0.33323
0.00000
22
-0.18348
-0.33324
0.00000
23
0.18342
-0.33312
0.00000
24
0.18342
0.33312
0.00000