Geometry & MOs

Info

ID:	51616
PubChem CID:	12014316
Reduced:	SO2C13H20 (1)
Stoich.:	AB2C13D20 (1)
Weight, g/mol:	332.144616
ΔH_f, kcal/mol:	-83.18
Dipole, Da:	3.09
IP(EA), eV:	-8.32(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2S)-2-(benzenesulfonyl)-4,4-dimethyl-1-phenylpentan-1-ol

Drug info:

PubChemData

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CCC[C@H]([C@H](C)O)[S@@](=O)C1=CC=C(C=C1)C

DOS

IR

Vibrations