Charge: -1
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-1
Electronic States
Energy
(eV)
-692.28642
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03906 b
(cm-1)
0.00844 c
(cm-1)
0.00694
Dipole Moments
mu_x(Debye)
-0.13629 mu_y
(Debye)
0.70909 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.77400
Diff mu Y
(Debye)
4.25300
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.01131
-0.07137
0.00000
2
-0.00768
-0.04987
0.00000
3
0.06615
-0.01712
0.00000
4
-0.08726
0.04859
0.00000
5
-0.07472
0.04106
0.00000
6
0.08532
-0.02789
0.00000
7
0.04074
0.05177
0.00000
8
0.01566
0.05903
0.00000
9
0.01988
0.05541
0.00000
10
0.01371
0.05568
0.00000
11
-0.06655
-0.06156
0.00000
12
0.03297
-0.04648
0.00000
13
0.02761
-0.04299
0.00000
14
-0.04983
-0.01871
0.00000
15
-0.03374
0.03598
0.00000
16
0.00731
-0.02442
0.00000
17
0.02445
0.00382
0.00000
18
-0.00105
0.02290
0.00000
19
0.02072
0.04942
0.00000
20
-0.05218
-0.21556
0.00000
21
0.00256
0.00376
0.00000
22
0.00704
0.02427
0.00000
23
0.01066
0.05532
0.00000
24
0.00572
-0.02290
0.00000
25
0.00894
-0.00513
0.00000
26
0.05374
-0.07305
0.00000
27
0.05792
-0.06354
0.00000
28
-0.00603
-0.06697
0.00000
29
-0.01036
-0.00501
0.00000
30
-0.11856
0.15468
0.00000