Charge: 1
Inchi:1S/C14H10/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h1-10H/q+1
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
0.00000
0.08649
0.00000
2
-0.00912
-0.08341
0.00000
3
0.00912
-0.08341
0.00000
4
-0.00912
0.08341
0.00000
5
0.00912
0.08341
0.00000
6
0.00000
-0.08649
0.00000
7
0.01428
0.07148
0.00000
8
-0.02461
-0.04709
0.00000
9
-0.02461
0.04709
0.00000
10
0.01428
-0.07148
0.00000
11
-0.01428
0.07149
0.00000
12
0.02462
-0.04709
0.00000
13
0.02462
0.04709
0.00000
14
-0.01428
-0.07149
0.00000
15
0.00000
-0.12303
0.00000
16
-0.01758
-0.09845
0.00000
17
-0.07233
0.00258
0.00000
18
-0.07233
-0.00258
0.00000
19
-0.01757
0.09845
0.00000
20
0.01757
-0.09844
0.00000
21
0.07233
0.00258
0.00000
22
0.07233
-0.00258
0.00000
23
0.01757
0.09844
0.00000
24
0.00000
0.12303
0.00000