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)
-539.72189
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)
0.07208 b
(cm-1)
0.01516 c
(cm-1)
0.01252
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
0.00473
0.00000
0.00000
2
-0.01028
0.01879
0.00000
3
-0.01028
-0.01879
0.00000
4
0.01028
0.01879
0.00000
5
0.01028
-0.01879
0.00000
6
-0.00474
0.00000
0.00000
7
0.04090
0.03066
0.00000
8
0.08510
-0.05426
0.00000
9
-0.08510
-0.05426
0.00000
10
-0.04090
0.03066
0.00000
11
0.04089
-0.03065
0.00000
12
0.08508
0.05424
0.00000
13
-0.08508
0.05425
0.00000
14
-0.04089
-0.03065
0.00000
15
0.00463
-0.00002
0.00000
16
0.04539
-0.22530
0.00000
17
0.19299
0.00102
0.00000
18
-0.19298
0.00103
0.00000
19
-0.04538
-0.22530
0.00000
20
0.04540
0.22537
0.00000
21
0.19303
-0.00102
0.00000
22
-0.19302
-0.00103
0.00000
23
-0.04540
0.22537
0.00000
24
-0.00463
-0.00002
0.00000