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)
-539.46223
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)
0.07234 b
(cm-1)
0.01515 c
(cm-1)
0.01253
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)
-0.92900
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.00461
0.00000
0.00000
2
-0.00461
0.00000
0.00000
3
-0.00682
0.06975
0.00000
4
-0.00682
-0.06975
0.00000
5
-0.00682
0.06975
0.00000
6
-0.00682
-0.06975
0.00000
7
-0.00731
-0.09531
0.00000
8
-0.00731
0.09531
0.00000
9
-0.00731
-0.09531
0.00000
10
-0.00731
0.09531
0.00000
11
0.02528
0.06042
0.00000
12
0.02528
-0.06042
0.00000
13
0.02528
0.06042
0.00000
14
0.02528
-0.06042
0.00000
15
-0.00726
0.00000
0.00000
16
-0.00726
0.00000
0.00000
17
-0.00868
0.14431
0.00000
18
-0.00868
-0.14431
0.00000
19
-0.00868
0.14431
0.00000
20
-0.00868
-0.14431
0.00000
21
-0.09298
0.00105
0.00000
22
-0.09298
-0.00105
0.00000
23
-0.09298
0.00105
0.00000
24
-0.09298
-0.00105
0.00000