Geometry & MOs

Info

ID:	358368
PubChem CID:	127295913
Reduced:	N2O2C21H24 (1)
Stoich.:	A2B2C21D24 (1)
Weight, g/mol:	393.10519
ΔH_f, kcal/mol:	-56.21
Dipole, Da:	4.34
IP(EA), eV:	-8.64(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-[2-oxo-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethyl]benzamide

Drug info:

PubChemData

Smile

C1CC(CCC1C(=O)N)NC(=O)C2CC2C3=CC=CC4=CC=CC=C43

DOS

IR

Vibrations