Geometry & MOs

Info

ID:	74780
PubChem CID:	48422456
Reduced:	ClNO2C17H24 (1)
Stoich.:	ABC2D17E24 (1)
Weight, g/mol:	399.179421
ΔH_f, kcal/mol:	-82.37
Dipole, Da:	3.3
IP(EA), eV:	-9.47(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations