Geometry & MOs

Info

ID:	75571
PubChem CID:	48423675
Reduced:	NO3C17H25 (1)
Stoich.:	AB3C17D25 (1)
Weight, g/mol:	418.08921
ΔH_f, kcal/mol:	-105.81
Dipole, Da:	2.82
IP(EA), eV:	-8.42(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[1-(4-bromophenyl)propan-2-ylamino]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)OCCNC(=O)C(C)OCC2CC2

DOS

IR

Vibrations