Geometry & MOs

Info

ID:	119255
PubChem CID:	50675110
Reduced:	ClO3N4C28H35 (1)
Stoich.:	AB3C4D28E35 (1)
Weight, g/mol:	530.185146
ΔH_f, kcal/mol:	-114.9
Dipole, Da:	4.0
IP(EA), eV:	-8.85(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[2-chloro-5-(cyclopentylcarbamoyl)anilino]-1-oxopropan-2-yl]-N-(2-chlorophenyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1NC(=O)C2CCN(CC2)C(C)C(=O)NC3=C(C=CC(=C3)C(=O)NC4CCCC4)Cl

DOS

IR

Vibrations