Geometry & MOs

Info

ID:	51618
PubChem CID:	12014318
Reduced:	SO3C16H24 (1)
Stoich.:	AB3C16D24 (1)
Weight, g/mol:	256.113316
ΔH_f, kcal/mol:	-135.39
Dipole, Da:	5.45
IP(EA), eV:	-10.21(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3R)-3-(benzenesulfonyl)-5-methylhexan-2-ol

Drug info:

PubChemData

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C[C@@H]([C@@H](CC1CCCCC1)S(=O)(=O)C2=CC=CC=C2)O

DOS

IR

Vibrations