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)
-539.72189
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)
0.07208 b
(cm-1)
0.01516 c
(cm-1)
0.01252
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)
-0.21700
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
-0.04361
0.00000
2
-0.00927
-0.00721
0.00000
3
0.00927
-0.00721
0.00000
4
0.00927
-0.00722
0.00000
5
-0.00927
-0.00721
0.00000
6
0.00000
-0.04362
0.00000
7
-0.00466
0.08131
0.00000
8
0.04950
-0.02444
0.00000
9
-0.04950
-0.02444
0.00000
10
0.00466
0.08131
0.00000
11
0.00466
0.08131
0.00000
12
-0.04950
-0.02444
0.00000
13
0.04950
-0.02444
0.00000
14
-0.00466
0.08131
0.00000
15
0.00000
0.14996
0.00000
16
0.00458
-0.27371
0.00000
17
0.12644
-0.13284
0.00000
18
-0.12644
-0.13283
0.00000
19
-0.00458
-0.27371
0.00000
20
-0.00458
-0.27373
0.00000
21
-0.12645
-0.13285
0.00000
22
0.12645
-0.13284
0.00000
23
0.00458
-0.27373
0.00000
24
0.00000
0.14997
0.00000