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)
-539.56791
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)
0.07196 b
(cm-1)
0.01474 c
(cm-1)
0.01223
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
-0.10100
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.07561
0.00000
0.00000
2
-0.07561
0.00000
0.00000
3
-0.02298
-0.04398
0.00000
4
-0.02298
0.04398
0.00000
5
-0.02298
-0.04398
0.00000
6
-0.02298
0.04398
0.00000
7
0.02891
-0.06938
0.00000
8
0.02891
0.06938
0.00000
9
0.02891
-0.06938
0.00000
10
0.02891
0.06938
0.00000
11
0.03652
-0.08119
0.00000
12
0.03652
0.08119
0.00000
13
0.03652
-0.08119
0.00000
14
0.03652
0.08119
0.00000
15
-0.07348
0.00000
0.00000
16
-0.07348
0.00000
0.00000
17
0.02937
-0.02274
0.00000
18
0.02937
0.02274
0.00000
19
0.02937
-0.02274
0.00000
20
0.02937
0.02274
0.00000
21
-0.04786
-0.12926
0.00000
22
-0.04786
0.12926
0.00000
23
-0.04786
-0.12926
0.00000
24
-0.04786
0.12926
0.00000