Charge: 2
Inchi:1S/C18H12/c1-2-7-15-12-18-16(11-14(15)6-1)10-9-13-5-3-4-8-17(13)18/h1-12H/q+2
Electronic States
Energy
(eV)
-691.62999
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03982 b
(cm-1)
0.00842 c
(cm-1)
0.00695
Dipole Moments
mu_x(Debye)
-0.27351 mu_y
(Debye)
0.67795 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
1.10400
Diff mu Y
(Debye)
-2.06500
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.01504
0.00023
0.00000
2
0.01200
0.00755
0.00000
3
0.04599
-0.00291
0.00000
4
-0.04072
-0.01659
0.00000
5
0.01079
-0.01758
0.00000
6
-0.01851
0.00418
0.00000
7
-0.08647
0.04432
0.00000
8
0.02743
0.01413
0.00000
9
-0.00102
0.02372
0.00000
10
0.00696
-0.00248
0.00000
11
0.08820
-0.04580
0.00000
12
-0.05494
0.02748
0.00000
13
0.01625
-0.01825
0.00000
14
-0.01558
0.00220
0.00000
15
0.07352
-0.07065
0.00000
16
-0.03733
0.03823
0.00000
17
0.11391
-0.02440
0.00000
18
-0.10840
0.06646
0.00000
19
-0.02245
-0.01725
0.00000
20
0.00297
-0.02776
0.00000
21
-0.01422
-0.02714
0.00000
22
0.00827
-0.00070
0.00000
23
0.00905
-0.06219
0.00000
24
-0.01626
0.01523
0.00000
25
0.00811
0.00917
0.00000
26
0.04793
-0.09527
0.00000
27
-0.09256
0.14370
0.00000
28
-0.07397
-0.03827
0.00000
29
-0.13468
-0.08859
0.00000
30
0.07490
-0.16615
0.00000