Geometry & MOs

Info

ID:	370894
PubChem CID:	127341220
Reduced:	FO2N3C20H28 (1)
Stoich.:	AB2C3D20E28 (1)
Weight, g/mol:	394.167477
ΔH_f, kcal/mol:	-130.84
Dipole, Da:	3.69
IP(EA), eV:	-9.45(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-ethyl-3-oxopiperazin-1-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide

Drug info:

PubChemData

Smile

CCC1C(=O)NCCN1CC(=O)NCC2(CCCC2)C3=CC=C(C=C3)F

DOS

IR

Vibrations