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)
0.16300
Diff mu Y
(Debye)
0.28900
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.02386
0.03675
0.00000
2
0.02387
0.03675
0.00000
3
-0.01406
-0.05867
0.00000
4
-0.07435
-0.06977
0.00000
5
-0.05951
-0.03767
0.00000
6
-0.01562
0.03717
0.00000
7
-0.00526
0.05420
0.00000
8
0.06590
0.06675
0.00000
9
0.04460
-0.00051
0.00000
10
0.03184
-0.01770
0.00000
11
0.03185
-0.01771
0.00000
12
0.04461
-0.00050
0.00000
13
0.06591
0.06677
0.00000
14
-0.00527
0.05421
0.00000
15
-0.01562
0.03717
0.00000
16
-0.05951
-0.03768
0.00000
17
-0.07437
-0.06977
0.00000
18
-0.01408
-0.05866
0.00000
19
-0.08726
-0.09883
0.00000
20
0.05354
0.04268
0.00000
21
-0.01216
-0.00867
0.00000
22
0.06714
0.06653
0.00000
23
-0.02217
-0.00373
0.00000
24
0.03188
-0.12383
0.00000
25
0.03189
-0.12384
0.00000
26
-0.02218
-0.00372
0.00000
27
0.06715
0.06654
0.00000
28
-0.01217
-0.00866
0.00000
29
0.05356
0.04267
0.00000
30
-0.08728
-0.09881
0.00000