Geometry & MOs

Info

ID:	64466
PubChem CID:	29200946
Reduced:	N2O3C21H26 (1)
Stoich.:	A2B3C21D26 (1)
Weight, g/mol:	456.01547
ΔH_f, kcal/mol:	-101.96
Dipole, Da:	3.26
IP(EA), eV:	-9.3(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromo-2-fluorophenoxy)-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide

Drug info:

PubChemData

Smile

CC(C)[C@@H](C(=O)NCCC1=CC=CC=C1)NC(=O)COC2=CC=CC=C2

DOS

IR

Vibrations