Charge: 1
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+1
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)
-0.04100
Diff mu Y
(Debye)
-0.67200
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.08547
0.00338
0.00000
2
-0.08548
0.00341
0.00000
3
-0.10435
-0.00709
0.00000
4
0.01508
0.00658
0.00000
5
0.05626
-0.03254
0.00000
6
0.05292
0.01069
0.00000
7
0.05755
0.04052
0.00000
8
0.00935
0.03895
0.00000
9
-0.01530
-0.01866
0.00000
10
0.02208
-0.05601
0.00000
11
0.02210
-0.05601
0.00000
12
-0.01527
-0.01866
0.00000
13
0.00939
0.03898
0.00000
14
0.05755
0.04054
0.00000
15
0.05291
0.01072
0.00000
16
0.05625
-0.03255
0.00000
17
0.01508
0.00653
0.00000
18
-0.10434
-0.00714
0.00000
19
0.04975
0.09451
0.00000
20
0.01042
-0.09037
0.00000
21
-0.06717
-0.02694
0.00000
22
-0.02081
0.07756
0.00000
23
0.06924
0.07225
0.00000
24
-0.13861
0.04163
0.00000
25
-0.13862
0.04169
0.00000
26
0.06923
0.07225
0.00000
27
-0.02077
0.07759
0.00000
28
-0.06717
-0.02694
0.00000
29
0.01044
-0.09035
0.00000
30
0.04974
0.09444
0.00000