Geometry & MOs

Info

ID:	68492
PubChem CID:	46508519
Reduced:	SN4O7C21H26 (1)
Stoich.:	AB4C7D21E26 (1)
Weight, g/mol:	481.06709
ΔH_f, kcal/mol:	-169.54
Dipole, Da:	8.63
IP(EA), eV:	-9.2(-1.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromophenyl)-2-[4-(2,6-dimethylmorpholin-4-yl)sulfonylanilino]acetamide

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=C(C=C2)NCC(=O)NC3=C(C=C(C=C3)OC)[N+](=O)[O-]

DOS

IR

Vibrations