Geometry & MOs

Info

ID:	277552
PubChem CID:	103829405
Reduced:	BrN2O4C11H13 (1)
Stoich.:	AB2C4D11E13 (1)
Weight, g/mol:	200.116092
ΔH_f, kcal/mol:	-41.51
Dipole, Da:	4.89
IP(EA), eV:	-9.88(-1.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methylpropoxy)-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)CONC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])Br

DOS

IR

Vibrations