Geometry & MOs

Info

ID:	68885
PubChem CID:	46511211
Reduced:	S2N3O4C18H23 (1)
Stoich.:	A2B3C4D18E23 (1)
Weight, g/mol:	433.06709
ΔH_f, kcal/mol:	-105.76
Dipole, Da:	4.24
IP(EA), eV:	-8.87(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromo-2-methylphenyl)-2-[(2,6-dimethylmorpholin-4-yl)sulfonyl-methylamino]acetamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CN2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)S(=O)(=O)N

DOS

IR

Vibrations