Geometry & MOs

Info

ID:	265450
PubChem CID:	103522243
Reduced:	BrNO2C15H24 (1)
Stoich.:	ABC2D15E24 (1)
Weight, g/mol:	310.06808
ΔH_f, kcal/mol:	-93.1
Dipole, Da:	1.55
IP(EA), eV:	-9.26(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[1-(4-bromophenyl)propan-2-ylamino]methyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC(CC1=CC=C(C=C1)Br)NCC(C)(CCOC)O

DOS

IR

Vibrations