Geometry & MOs

Info

ID:	107067
PubChem CID:	50187806
Reduced:	N6O7C35H46 (1)
Stoich.:	A6B7C35D46 (1)
Weight, g/mol:	518.325691
ΔH_f, kcal/mol:	-273.27
Dipole, Da:	8.8
IP(EA), eV:	-8.86(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[4-(cyclohexylcarbamoyl)-2-methylanilino]-2-oxoethyl]-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)N2CCOCC2)NC(=O)C(C)N3CCC(CC3)C(=O)NCCC(=O)NC4=CC=CC=C4C(=O)N5CCOCC5

DOS

IR

Vibrations