Geometry & MOs

Info

ID:	119989
PubChem CID:	50710382
Reduced:	Cl2O4N5C24H27 (1)
Stoich.:	A2B4C5D24E27 (1)
Weight, g/mol:	567.261232
ΔH_f, kcal/mol:	-149.83
Dipole, Da:	4.82
IP(EA), eV:	-9.24(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[2-chloro-5-(methylcarbamoyl)anilino]-2-oxoethyl]-N-[2-[(2-methylcyclohexyl)carbamoyl]phenyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)C1=CC(=C(C=C1)Cl)NC(=O)CN2CCC(CC2)C(=O)NC3=C(C=CC(=C3)C(=O)NC)Cl

DOS

IR

Vibrations