Accuracy
lithium sulfate anion
2179 Lithium sulfate anion
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Geometry predicted using PM7
ΔHf: -247.3 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.
SHIFT=5 CHARGE=-1 PULAY PM7
Lithium sulfate anion
H=-247.3 HR=NIST
S 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
O 1.56301646 +1 0.0000000 +0 0.0000000 +0 1 0 0
O 1.48174449 +1 111.2875431 +1 0.0000000 +0 1 2 0
O 1.56240927 +1 95.8950176 +1 -115.7160793 +1 1 2 3
O 1.48170435 +1 111.3271904 +1 128.6250628 +1 1 2 3
Li 1.80043604 +1 92.0878329 +1 115.7853660 +1 2 1 3