Charge: 1
Inchi:1S/C10H9/c1-2-5-9-7-4-8-10(9)6-3-1/h1-3,5-8H,4H2/q+1
Electronic States
Energy
(eV)
-385.85306
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09480 b
(cm-1)
0.04163 c
(cm-1)
0.02893
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.43892
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
-0.14600
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
-0.07345
0.00000
2
0.00000
-0.07175
0.01488
3
0.00000
-0.07175
-0.01488
4
0.00000
0.04757
0.00091
5
0.00000
0.04756
-0.00091
6
0.00000
0.10765
-0.04872
7
0.00000
0.10764
0.04873
8
0.00000
0.00313
0.09053
9
0.00000
0.00313
-0.09053
10
0.00000
-0.07185
0.00000
11
0.00000
-0.04658
0.00000
12
0.00000
-0.10000
0.02081
13
0.00000
-0.10000
-0.02081
14
0.00000
0.06986
0.10387
15
0.00000
0.06986
-0.10388
16
0.00000
-0.03100
0.19235
17
0.00000
-0.03101
-0.19235
18
0.00000
-0.16312
0.00000