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)
-539.31632
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)
0.07158 b
(cm-1)
0.01500 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)
0.10200
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.10303
0.00000
0.00000
2
-0.10303
0.00000
0.00000
3
0.01420
-0.01972
0.00000
4
0.01420
0.01972
0.00000
5
0.01420
-0.01972
0.00000
6
0.01420
0.01972
0.00000
7
0.08528
0.00070
0.00000
8
0.08528
-0.00070
0.00000
9
0.08528
0.00070
0.00000
10
0.08528
-0.00070
0.00000
11
-0.04597
0.05841
0.00000
12
-0.04597
-0.05841
0.00000
13
-0.04597
0.05841
0.00000
14
-0.04597
-0.05841
0.00000
15
-0.10598
0.00000
0.00000
16
-0.10598
0.00000
0.00000
17
0.08609
-0.08038
0.00000
18
0.08609
0.08038
0.00000
19
0.08609
-0.08038
0.00000
20
0.08609
0.08038
0.00000
21
-0.05695
0.05212
0.00000
22
-0.05695
-0.05212
0.00000
23
-0.05695
0.05212
0.00000
24
-0.05695
-0.05212
0.00000