Geometry & MOs

Info

ID:	76216
PubChem CID:	48424607
Reduced:	NO2C12H15 (2)
Stoich.:	AB2C12D15 (2)
Weight, g/mol:	409.200156
ΔH_f, kcal/mol:	-126.4
Dipole, Da:	4.35
IP(EA), eV:	-8.87(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-oxo-1-[[4-(2-oxopiperidin-1-yl)phenyl]methylamino]-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NC(=O)COC2=CC=C(C=C2)CCNC(=O)C(C)OCC3CC3

DOS

IR

Vibrations