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)
-0.44100
Diff mu Y
(Debye)
-2.99100
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.02489
-0.06090
0.00000
2
0.04605
-0.02862
0.00000
3
0.07249
-0.02221
0.00000
4
-0.02132
0.10600
0.00000
5
-0.04180
0.06310
0.00000
6
-0.03669
-0.08450
0.00000
7
0.07589
0.03122
0.00000
8
-0.00623
0.05216
0.00000
9
0.02579
0.03532
0.00000
10
0.00529
-0.00680
0.00000
11
0.00097
-0.00403
0.00000
12
-0.01390
-0.05873
0.00000
13
0.00166
-0.02443
0.00000
14
-0.01698
0.02249
0.00000
15
-0.04157
0.01549
0.00000
16
-0.00004
-0.02386
0.00000
17
0.00858
0.00765
0.00000
18
-0.01363
0.00225
0.00000
19
-0.04836
-0.15098
0.00000
20
0.06958
0.01972
0.00000
21
0.00848
-0.03169
0.00000
22
0.02758
0.07957
0.00000
23
-0.14271
-0.38793
0.00000
24
0.02337
-0.04761
0.00000
25
0.11972
0.06020
0.00000
26
-0.14175
0.07201
0.00000
27
-0.14692
0.14336
0.00000
28
0.00702
-0.00582
0.00000
29
-0.00718
0.00469
0.00000
30
-0.00299
-0.01245
0.00000