Geometry & MOs

Info

ID:	403902
PubChem CID:	135062499
Reduced:	S2N3O6H19C21 (1)
Stoich.:	A2B3C6D19E21 (1)
Weight, g/mol:	383.120272
ΔH_f, kcal/mol:	-63.59
Dipole, Da:	7.82
IP(EA), eV:	-8.99(-1.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-3-[2-(benzenesulfonyl)-1-fluorocyclopropanecarbonyl]-5,5-dimethyl-4-propan-2-yl-1,3-oxazolidin-2-one

Drug info:

PubChemData

Smile

C[C@@H]([C@H](C1=CSC=C1)NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])C(=O)C(=O)NC3=CC=CC=C3

DOS

IR

Vibrations