Geometry & MOs

Info

ID:	106163
PubChem CID:	50151089
Reduced:	O3N4C29H38 (1)
Stoich.:	A3B4C29D38 (1)
Weight, g/mol:	518.325691
ΔH_f, kcal/mol:	-115.16
Dipole, Da:	6.39
IP(EA), eV:	-8.8(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[2-methyl-4-(3-methylpiperidine-1-carbonyl)anilino]-2-oxoethyl]-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1CCCN(C1)C(=O)C2=CC(=C(C=C2)NC(=O)CN3CCC(CC3)C(=O)NC4=CC=CC=C4C)C

DOS

IR

Vibrations