Geometry & MOs

Info

ID:	76019
PubChem CID:	48424308
Reduced:	BrNO2C17H22 (1)
Stoich.:	ABC2D17E22 (1)
Weight, g/mol:	374.195405
ΔH_f, kcal/mol:	-55.57
Dipole, Da:	4.98
IP(EA), eV:	-9.39(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-oxo-1-[4-(2-oxoimidazolidin-1-yl)piperidin-1-yl]-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)N1CCCC1C2=CC(=CC=C2)Br)OCC3CC3

DOS

IR

Vibrations