Geometry & MOs

Info

ID:	236737
PubChem CID:	92714609
Reduced:	SN3O5C19H21 (1)
Stoich.:	AB3C5D19E21 (1)
Weight, g/mol:	403.120192
ΔH_f, kcal/mol:	-152.74
Dipole, Da:	5.61
IP(EA), eV:	-9.53(-1.16)
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-[(1S)-1-phenylethyl]acetamide

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC=C1)NC(=O)CN(C)S(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3

DOS

IR

Vibrations