PM7 Accuracy Date:Mon Feb 11 04:20:05 2019

ethylsilane   1885 Ethylsilane

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    #  Species Formula
  1875 Silyl, anionH3Si
  1876 Silane (Geo)H4Si
  1877 SilaneH4Si
  1878 B5H8-SiH3 (Geo)H11B5Si
  1879 MethylsilylCH5Si
  1880 MethylsilaneCH6Si
  1881 Methylsilane (Geo)CH6Si
  1882 VinylsilaneC2H6Si
  1883 DimethylsilylC2H7Si
  1884 DimethylsilaneC2H8Si
  1885 Ethylsilane C2H8Si
  1886 TrimethylsilylC3H9Si
  1887 TrimethylsilaneC3H10Si
  1888 DiethylsilaneC4H12Si
  1889 Tetramethylsilane (Geo)C4H12Si
  1890 TetramethylsilaneC4H12Si
  1891 1,1-DimethylsilacyclobutaneC5H12Si
  1892 TriethylsilaneC6H16Si
  1893 SiC4(-) (FOGMET) (Geo)C8H13Si
  1894 SiC4(-) (FOGMET)C8H13Si
  1895 TetraethylsilaneC8H20Si


ΔHf: -15.0 kcal/mol,     REF: W. C. Steele, L. D. Nichols, F. G. A. Stone, J. Am. Chem. Soc., 84, 4441 (1962)
Dipole: 0.8 Debye,     REF: A. L. McClellan, "Tables of Experimental Dipole Moments," Vol 2, Rahara Enterprises, El Cerrito, (1974).
I.P.: 10.2 eV,     REF: H. M. Rosenstock, K. Draxl, B. W. Steiner, J. T. Herron, "Energetics of Gaseous Ions," J. Phys. Ref. Data, 6 Suppl. 1 (1977).
  
 PM7
Ethylsilane
 H=-15 I=10.18 IR=RDSH1977 DR=MCC1974 D=0.81 HR=SNS1962
  H     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Si     1.45448811 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.86417604 +1  108.3068561 +1    0.0000000 +0     2     1     0
  C     1.53330241 +1  115.2729510 +1 -179.9867091 +1     3     2     1
  H     1.45336442 +1  110.6437680 +1  -60.6117437 +1     2     3     4
  H     1.45338078 +1  110.6633856 +1   60.5661907 +1     2     3     4
  H     1.11838647 +1  109.3873110 +1   57.0616187 +1     3     2     1
  H     1.11832043 +1  109.3740428 +1  -57.1132031 +1     3     2     1
  H     1.10054691 +1  110.1827253 +1 -179.9083710 +1     4     3     2
  H     1.09894600 +1  113.2453399 +1   61.4752231 +1     4     3     2
  H     1.09894894 +1  113.2635232 +1  -61.2766211 +1     4     3     2