Geometry & MOs

Info

ID:	75832
PubChem CID:	48424039
Reduced:	ClN2O4C19H21 (1)
Stoich.:	AB2C4D19E21 (1)
Weight, g/mol:	324.241293
ΔH_f, kcal/mol:	-138.93
Dipole, Da:	4.11
IP(EA), eV:	-8.55(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(cyclopropylmethoxy)propanoyl]-N-(3-methylbutyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)NC(=O)C(CC2=CC=CC=C2)NC(=O)OC)Cl

DOS

IR

Vibrations