Charge: 2
Inchi:1S/C14H10/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h1-10H/q+2
Electronic States
Energy
(eV)
-538.83524
Description
D0
Multiplicity
2
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)
0.07213 b
(cm-1)
0.01479 c
(cm-1)
0.01228
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)
1.06900
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.03040
2
0.00000
0.00000
0.03040
3
0.00000
0.00000
0.01285
4
0.00000
0.00000
0.01285
5
0.00000
0.00000
0.01285
6
0.00000
0.00000
0.01285
7
0.00000
0.00000
-0.02731
8
0.00000
0.00000
-0.02731
9
0.00000
0.00000
-0.02731
10
0.00000
0.00000
-0.02731
11
0.00000
0.00000
-0.03640
12
0.00000
0.00000
-0.03640
13
0.00000
0.00000
-0.03640
14
0.00000
0.00000
-0.03640
15
0.00000
0.00000
-0.30365
16
0.00000
0.00000
-0.30365
17
0.00000
0.00000
0.24523
18
0.00000
0.00000
0.24523
19
0.00000
0.00000
0.24523
20
0.00000
0.00000
0.24523
21
0.00000
0.00000
0.33120
22
0.00000
0.00000
0.33120
23
0.00000
0.00000
0.33120
24
0.00000
0.00000
0.33120