Accuracy
t-butylamine
386 t-Butylamine
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Geometry predicted using PM7
ΔHf: -28.9 kcal/mol, REF: J. O. Cox, G. Pilcher, "Thermochemistry of Organic and Organometallic Compounds," Academic Press, New York, N.Y., 1970.
t-Butylamine
H=-28.9 HR=C&P1970
C -0.01510274 +1 -0.00544808 +1 0.00121044 +1
C 1.53066951 +1 0.00414166 +1 0.01872681 +1
C 2.03853817 +1 1.45663158 +1 0.00336883 +1
H 3.13566237 +1 1.47881305 +1 -0.03880232 +1
C 2.03809853 +1 -0.72201862 +1 1.27684584 +1
N 2.09187082 +1 -0.68890324 +1 -1.16558088 +1
H 1.72465998 +1 1.99607873 +1 0.90124780 +1
H 1.66923547 +1 2.00682939 +1 -0.86702050 +1
H -0.40822905 +1 -1.02574171 +1 0.00837001 +1
H -0.40744875 +1 0.50064331 +1 -0.88505617 +1
H -0.42075008 +1 0.50789732 +1 0.87819426 +1
H 1.72653981 +1 -0.20325613 +1 2.18738915 +1
H 3.13517847 +1 -0.77195933 +1 1.27384838 +1
H 1.66690634 +1 -1.74974230 +1 1.33053823 +1
H 1.83048648 +1 -0.24424126 +1 -2.02841799 +1
H 1.82889382 +1 -1.65841285 +1 -1.20113040 +1