PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
calcium hydroxide
2742 Calcium hydroxide
(Previous)
(Back)
(Next)
ΔHf: -146.0 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
Calcium hydroxide
H=-146.0 HR=NIST
Ca 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
O 1.87386541 +1 0.0000000 +0 0.0000000 +0 1 0 0
O 1.87386586 +1 180.0000000 +0 0.0000000 +0 1 2 0
H 0.88155062 +1 179.8805606 +1 -90.1080579 +1 2 1 3
H 0.88155068 +1 179.8118074 +1 92.7221900 +1 3 1 2