Accuracy
4,5-dihydro-2-methyl oxazole
935 4,5-Dihydro-2-methyl oxazole
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Geometry predicted using PM7
ΔHf: -31.2 kcal/mol, REF: NIST Chemistry WebBook, NIST Standard Reference Database, No. 69; W. G. Mallard, P. J. Linstrom, Eds., National Institute of Standards and Technology, Gaithersberg, http://webbook.nist.gov/chemistry.
PM7
4,5-Dihydro-2-methyl oxazole
H=-31.18 HR=NIST
N 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
C 1.29134977 +1 0.0000000 +0 0.0000000 +0 1 0 0
C 1.47312427 +1 108.9183897 +1 0.0000000 +0 1 2 0
C 1.55345789 +1 103.7980701 +1 -0.0063150 +1 3 1 2
O 1.44178148 +1 104.3887270 +1 -0.0264192 +1 4 3 1
C 1.47314504 +1 130.6734486 +1 -179.9818127 +1 2 1 3
H 1.10727855 +1 109.5841111 +1 -121.1996753 +1 3 1 4
H 1.10731610 +1 109.5784070 +1 -117.7112296 +1 3 1 7
H 1.09811405 +1 114.2550483 +1 -115.1609533 +1 4 3 5
H 1.09795856 +1 114.2354243 +1 -129.5541403 +1 4 3 9
H 1.10344215 +1 111.2962690 +1 119.8688585 +1 6 2 1
H 1.10344310 +1 111.3125557 +1 119.3550472 +1 6 2 11
H 1.10412078 +1 111.4115770 +1 120.3420636 +1 6 2 12