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Compuesto atomos catindad de A # orbital total de orbitales

C 1 4 4
metanol O 1 4 4
H 4 1 4
C 2 4 8
Etanol O 1 4 4
H 6 1 6
C 3 4 12
propannol O 1 4 4
H 8 1 8
C 4 4 16
butanol O 1 4 4
H 10 1 10
C 5 4 20
pentanol O 1 4 4
H 12 1 12
C 1 4 4
A. metanoico O 2 4 8
H 2 1 2
C 2 4 8
A. acetico O 2 4 8
H 4 1 4
C 3 4 12
A, propanoico O 2 4 8
H 6 1 6
C 4 4 16
A. butanoico O 2 4 8
H 8 1 8
C 5 4 20
A. pentanoico O 2 4 8
H 10 1 10
niveles niveles
#e total de e completos Homo Lumu
totales
4 4
6 6 12 14 7 8
1 4
4 8
6 6 18 20 10 11
1 6
4 12
6 6 24 26 13 14
1 8
4 16
6 6 30 32 16 17
1 10
4 20
6 6 36 38 19 20
1 12
4 4
6 12 14 18 9 10
1 2
4 8
6 12 20 24 12 13
1 4
4 12
6 12 26 30 15 16
1 6
4 16
6 12 32 36 18 19
1 8
4 20
6 12 38 42 21 22
1 10
Diagramas

Molecula Homo Lumo


Compuesto componente Homo Lumo
O1 -.00004 .54577
A. metanoico O2 0.00028 0.253
C 0.0004 -0.79859
O1 0.02139 -0.236
O2 0.04596 -0.54914
A.butanoico
C1 -0.00119 0.00462
C6 -0.00917 0.7546
O1 -0.0716 -0.6859
O2 0.0058 0.66578
A,pentanoico C1 -0.2723 -0.0105
c2 0.41765 -0.0188
C3 0.3481 0.0227
O1 0.00237 -0.55232
O2 0.00186 -0.23662
a.etanoico
C 0.0006 0.75381
C2 0.0162 0.1221
O1 0.04415 0.23217
O2 0.09928 0.5441
A.propanoico
C1 -0.0167 0.01978
C3 -0.0187 -0.7454

O -0.38337 -0.0417
C1 -0.042 -0.074
butanol
C2 0.0662 0.1468
C3 0.13719 0.17598
O 0.40506 -0.05
etanol C1 0.053 -0.299
C2 -0.165 -0.5778
O 0.82305 0.00197
metanol
C -0.282 -0.0105
O -0.208 0.009
C1 0.0005 0.2504
C2 0.0011 0.2504
pentanol
C3 0.0016 0.35281
C4 -0.024 0.3821
C5 0.067 0.3063
O 0.183 0.024
C 0.0025 0.241
propanol
C 0.023 -0.449
C 0.0592 -0.443
1.56

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