Geometry & MOs

Info

ID:	75747
PubChem CID:	48423931
Reduced:	NO4C17H25 (1)
Stoich.:	AB4C17D25 (1)
Weight, g/mol:	409.236542
ΔH_f, kcal/mol:	-141.24
Dipole, Da:	2.28
IP(EA), eV:	-8.38(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C=C1)OC)OC)NC(=O)C(C)OCC2CC2

DOS

IR

Vibrations