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)
-692.28444
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03906 b
(cm-1)
0.00854 c
(cm-1)
0.00701
Dipole Moments
mu_x(Debye)
0.02298 mu_y
(Debye)
-0.00245 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.09000
Diff mu Y
(Debye)
-0.24700
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.06671
0.02609
0.00000
2
0.04222
0.01255
0.00000
3
0.04912
-0.01841
0.00000
4
-0.03816
-0.00165
0.00000
5
-0.02371
0.02615
0.00000
6
0.01033
0.02023
0.00000
7
-0.03198
-0.06382
0.00000
8
-0.10044
-0.00843
0.00000
9
-0.04376
0.00313
0.00000
10
-0.01825
-0.00437
0.00000
11
0.02019
-0.01598
0.00000
12
0.11618
0.04576
0.00000
13
0.01430
0.00424
0.00000
14
0.01419
-0.04152
0.00000
15
-0.07976
-0.05285
0.00000
16
0.04809
0.00074
0.00000
17
-0.01067
0.07625
0.00000
18
-0.03548
-0.00948
0.00000
19
0.09868
0.13772
0.00000
20
0.05790
0.07161
0.00000
21
-0.06035
-0.05048
0.00000
22
-0.01229
0.01274
0.00000
23
-0.15263
-0.17416
0.00000
24
0.01624
0.00004
0.00000
25
0.01541
-0.04203
0.00000
26
0.20380
-0.04436
0.00000
27
-0.17136
0.05009
0.00000
28
0.05193
0.02035
0.00000
29
-0.02918
0.07342
0.00000
30
-0.00785
-0.03848
0.00000