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)
-385.33849
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09497 b
(cm-1)
0.04175 c
(cm-1)
0.02900
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.45804
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.17600
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.14850
2
0.00000
0.09714
-0.01232
3
0.00000
-0.09714
-0.01232
4
0.00000
-0.03369
0.08275
5
0.00000
0.03369
0.08275
6
0.00000
0.02557
0.02379
7
0.00000
-0.02557
0.02379
8
0.00000
0.01605
-0.01184
9
0.00000
-0.01605
-0.01184
10
0.00000
0.00000
-0.04898
11
0.00000
0.00000
-0.15701
12
0.00000
-0.19468
0.09493
13
0.00000
0.19468
0.09493
14
0.00000
-0.00319
0.24368
15
0.00000
0.00319
0.24368
16
0.00000
0.02406
-0.03985
17
0.00000
-0.02406
-0.03985
18
0.00000
0.00000
-0.05095