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)
-538.15913
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)
0.07177 b
(cm-1)
0.01497 c
(cm-1)
0.01239
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
0.01087
0.00000
2
0.00000
-0.01087
0.00000
3
-0.08142
0.03323
0.00000
4
-0.08142
-0.03322
0.00000
5
0.08142
-0.03323
0.00000
6
0.08142
0.03322
0.00000
7
-0.05163
0.07688
0.00000
8
-0.05163
-0.07687
0.00000
9
0.05163
-0.07688
0.00000
10
0.05163
0.07687
0.00000
11
0.00564
0.04293
0.00000
12
0.00564
-0.04291
0.00000
13
-0.00564
-0.04293
0.00000
14
-0.00564
0.04291
0.00000
15
0.00000
-0.09051
0.00000
16
0.00000
0.09051
0.00000
17
-0.05195
0.11934
0.00000
18
-0.05196
-0.11933
0.00000
19
0.05195
-0.11934
0.00000
20
0.05196
0.11933
0.00000
21
0.06307
0.07637
0.00000
22
0.06307
-0.07635
0.00000
23
-0.06307
-0.07637
0.00000
24
-0.06307
0.07635
0.00000