PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
sulfur, anion
2050 Sulfur, anion
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Jmol._Canvas2D (Jmol) "jmolApplet0"
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Species
Formula
2040
Methyl triphosphate
CH7O10P3
2041
Phosphorus tetramer (Geo)
P4
2042
Phosphorus, tetramer
P4
2043
Phosphorus trioxide (Geo)
O6P4
2044
Phosphorus trioxide
O6P4
2045
Phosphorus pentoxide (Geo)
O10P4
2046
Phosphorus pentoxide
O10P4
2047
Mg(II)O6(2-) (FAPSIY) (Geo)
C4H16O16MgP4
2048
Sulfur, cation
S
2049
Sulfur, atom
S
2050
Sulfur, anion
S
2051
Hydrogen sulfide (HS)
HS
2052
Hydrogen sulfide, anion
HS
2053
Hydrogen sulfide (Geo)
H2S
2054
Hydrogen sulfide (H2S)
H2S
2055
Beryllium sulfide (Geo)
BeS
2056
Boron sulfide
BS
2057
S=B-H (Geo)
HBS
2058
Carbon sulfide
CS
2059
Carbon sulfide (Geo)
CS
2060
Thioformaldehyde (Geo)
CH2S
Δ
H
f
:
16.8 kcal/mol,
REF:
M. W. Chase, C. A. Davies, J. R. Downey, D. R. Frurip, R. A. McDonald, A. N. Syverud, JANAF Thermochemical Tables, Third Edition, J. Phys. Chem. Ref. Data 14, Suppl. 1 (1985).
OPEN(5,3) CHARGE=-1 PM7 Sulfur, anion H=16.77 HR=JANAF86 S 0.00000000 +0 0.00000000 +0 0.00000000 +0