Geometry & MOs

Info

ID:	74491
PubChem CID:	48421951
Reduced:	N3O3C18H29 (1)
Stoich.:	A3B3C18D29 (1)
Weight, g/mol:	347.220892
ΔH_f, kcal/mol:	-130.88
Dipole, Da:	4.52
IP(EA), eV:	-8.29(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[4-(2-methylpropyl)piperazin-1-yl]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C(CC1=CC=CC=C1)NC(=O)OC)CN(C)C

DOS

IR

Vibrations