Geometry & MOs

Info

ID:	202859
PubChem CID:	79734831
Reduced:	BrON2C16H17 (1)
Stoich.:	ABC2D16E17 (1)
Weight, g/mol:	311.02694
ΔH_f, kcal/mol:	-2.49
Dipole, Da:	5.55
IP(EA), eV:	-9.19(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-bromo-4-methylpyridin-2-yl)-2-(2-oxopyrrolidin-1-yl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=NC=C1Br)NC(=O)CCCC2=CC=CC=C2

DOS

IR

Vibrations