Geometry & MOs

Info

ID:	119584
PubChem CID:	50692013
Reduced:	ClN4O4C28H35 (1)
Stoich.:	AB4C4D28E35 (1)
Weight, g/mol:	510.239769
ΔH_f, kcal/mol:	-149.65
Dipole, Da:	8.78
IP(EA), eV:	-8.81(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[2-chloro-5-(piperidine-1-carbonyl)anilino]-2-oxoethyl]-N-(3,4-dimethylphenyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1NC(=O)C2CCN(CC2)CC(=O)NC3=C(C=CC(=C3)C(=O)N4CCCCC4)Cl

DOS

IR

Vibrations