Geometry & MOs

Info

ID:	75468
PubChem CID:	48423511
Reduced:	N3O3C20H31 (1)
Stoich.:	A3B3C20D31 (1)
Weight, g/mol:	409.200156
ΔH_f, kcal/mol:	-138.33
Dipole, Da:	3.11
IP(EA), eV:	-8.67(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-oxo-3-phenyl-1-[4-(2-phenylacetyl)piperazin-1-yl]propan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC1CCCCN1C(C)CNC(=O)C(CC2=CC=CC=C2)NC(=O)OC

DOS

IR

Vibrations