Geometry & MOs

Info

ID:	236736
PubChem CID:	92714608
Reduced:	ClSN2O4H17C18 (1)
Stoich.:	ABC2D4E17F18 (1)
Weight, g/mol:	403.120192
ΔH_f, kcal/mol:	-118.71
Dipole, Da:	5.19
IP(EA), eV:	-9.26(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[methyl-[(3-oxo-4H-1,4-benzoxazin-6-yl)sulfonyl]amino]-N-[(1R)-1-phenylethyl]acetamide

Drug info:

PubChemData

Smile

C1C[C@@H](C2=CC=CC=C2C1)NS(=O)(=O)C3=C(C=C4C(=C3)OCC(=O)N4)Cl

DOS

IR

Vibrations