Geometry & MOs

Info

ID:	75141
PubChem CID:	48423081
Reduced:	ClN2O2C19H27 (1)
Stoich.:	AB2C2D19E27 (1)
Weight, g/mol:	405.262757
ΔH_f, kcal/mol:	-76.4
Dipole, Da:	3.18
IP(EA), eV:	-9.09(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[(3-ethyl-2-morpholin-4-ylpentyl)amino]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)NC1CCN(CC1)CC2=CC=C(C=C2)Cl)OCC3CC3

DOS

IR

Vibrations