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)
-0.49100
Diff mu Y
(Debye)
1.12600
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.04115
0.01390
0.00000
2
0.04115
0.01391
0.00000
3
-0.03411
-0.03205
0.00000
4
-0.02832
0.03778
0.00000
5
0.04706
-0.02963
0.00000
6
0.05017
-0.05055
0.00000
7
-0.06330
0.03648
0.00000
8
0.03455
0.00116
0.00000
9
0.02914
-0.01010
0.00000
10
-0.09008
0.02596
0.00000
11
-0.09008
0.02596
0.00000
12
0.02914
-0.01010
0.00000
13
0.03455
0.00116
0.00000
14
-0.06329
0.03647
0.00000
15
0.05017
-0.05055
0.00000
16
0.04706
-0.02963
0.00000
17
-0.02832
0.03778
0.00000
18
-0.03411
-0.03205
0.00000
19
0.03603
0.21078
0.00000
20
-0.11504
-0.02033
0.00000
21
0.19069
0.01655
0.00000
22
0.10442
-0.08642
0.00000
23
-0.05824
0.05784
0.00000
24
0.00567
-0.09445
0.00000
25
0.00568
-0.09446
0.00000
26
-0.05824
0.05782
0.00000
27
0.10441
-0.08641
0.00000
28
0.19068
0.01655
0.00000
29
-0.11503
-0.02031
0.00000
30
0.03604
0.21078
0.00000