Geometry & MOs

Info

ID:	61670
PubChem CID:	26711666
Reduced:	ClNSO4H18C20 (1)
Stoich.:	ABCD4E18F20 (1)
Weight, g/mol:	486.00157
ΔH_f, kcal/mol:	-96.84
Dipole, Da:	4.61
IP(EA), eV:	-9.61(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-[2-(4-chlorophenyl)ethyl]-5-morpholin-4-ylsulfonylbenzamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)S(=O)(=O)CC2=CC=C(O2)C(=O)NCCC3=CC=C(C=C3)Cl

DOS

IR

Vibrations