Charge: 2
Inchi:1S/C18H12/c1-3-7-15-13(5-1)9-11-18-16-8-4-2-6-14(16)10-12-17(15)18/h1-12H/q+2
Electronic States
Energy
(eV)
-691.62195
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2h
Symmetry Elements
E
C2(z)
sigmah(xy)
i
Rotational Constants
(cm-1)
0.04269 b
(cm-1)
0.00858 c
(cm-1)
0.00715
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)
0.03800
Diff mu Y
(Debye)
-0.01600
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.00029
-0.00018
0.00000
2
0.00026
0.00011
0.00000
3
-0.00713
-0.00271
0.00000
4
0.04616
-0.01763
0.00000
5
-0.00136
-0.00175
0.00000
6
-0.00017
-0.00002
0.00000
7
-0.00348
0.00102
0.00000
8
0.00099
0.00078
0.00000
9
0.00050
-0.00157
0.00000
10
-0.00812
0.00312
0.00000
11
0.01060
-0.00405
0.00000
12
-0.00066
0.00199
0.00000
13
-0.00089
-0.00075
0.00000
14
0.00293
-0.00081
0.00000
15
0.00030
0.00007
0.00000
16
0.00181
0.00227
0.00000
17
-0.06079
0.02321
0.00000
18
0.00925
0.00353
0.00000
19
-0.52039
0.20520
0.00000
20
0.09215
-0.03235
0.00000
21
-0.00345
0.02118
0.00000
22
-0.01147
-0.00888
0.00000
23
0.03900
-0.01251
0.00000
24
-0.09809
-0.06529
0.00000
25
0.07535
0.05019
0.00000
26
-0.03299
0.01057
0.00000
27
0.01038
0.00804
0.00000
28
0.00439
-0.02695
0.00000
29
-0.12018
0.04217
0.00000
30
0.68532
-0.27023
0.00000