Geometry & MOs

Info

ID:	74642
PubChem CID:	48422224
Reduced:	N3O3C20H21 (1)
Stoich.:	A3B3C20D21 (1)
Weight, g/mol:	361.200156
ΔH_f, kcal/mol:	-54.69
Dipole, Da:	4.15
IP(EA), eV:	-9.64(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(CC1=CC(=CC=C1)C#N)C(=O)C(CC2=CC=CC=C2)NC(=O)OC

DOS

IR

Vibrations