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)
0.21100
Diff mu Y
(Debye)
-0.01400
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00197
-0.00091
0.00000
2
0.00196
-0.00091
0.00000
3
-0.03973
-0.02689
0.00000
4
-0.00601
0.00362
0.00000
5
0.00070
0.00076
0.00000
6
0.00058
0.00092
0.00000
7
-0.02924
0.00939
0.00000
8
-0.00783
-0.00654
0.00000
9
0.00181
-0.00880
0.00000
10
0.00221
-0.00043
0.00000
11
0.00220
-0.00043
0.00000
12
0.00180
-0.00876
0.00000
13
-0.00780
-0.00652
0.00000
14
-0.02913
0.00935
0.00000
15
0.00057
0.00091
0.00000
16
0.00070
0.00076
0.00000
17
-0.00603
0.00363
0.00000
18
-0.03988
-0.02699
0.00000
19
0.06535
-0.02756
0.00000
20
-0.02121
0.00726
0.00000
21
-0.01525
0.09496
0.00000
22
0.08486
0.06780
0.00000
23
0.33561
-0.11342
0.00000
24
0.45202
0.31587
0.00000
25
0.45037
0.31472
0.00000
26
0.33424
-0.11296
0.00000
27
0.08458
0.06757
0.00000
28
-0.01519
0.09460
0.00000
29
-0.02113
0.00724
0.00000
30
0.06556
-0.02764
0.00000