Geometry & MOs

Info

ID:	280423
PubChem CID:	103849200
Reduced:	BrNO4C14H18 (1)
Stoich.:	ABC4D14E18 (1)
Weight, g/mol:	256.142307
ΔH_f, kcal/mol:	-155.61
Dipole, Da:	5.14
IP(EA), eV:	-9.38(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-N-[(3-hydroxyoxolan-3-yl)methyl]-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

C1COCC1(CNC(=O)CCOC2=CC(=CC=C2)Br)O

DOS

IR

Vibrations