Geometry & MOs

Info

ID:	337092
PubChem CID:	127256657
Reduced:	OC9H9 (2)
Stoich.:	AB9C9 (2)
Weight, g/mol:	316.07693
ΔH_f, kcal/mol:	-52.73
Dipole, Da:	5.11
IP(EA), eV:	-9.26(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S,6S)-5-(benzenesulfonyl)-6-phenyloxan-2-one

Drug info:

PubChemData

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CC1=CC=C(C=C1)[C@@H]2C[C@H](CC(=O)O2)C3=CC=CC=C3

DOS

IR

Vibrations