Geometry & MOs

Info

ID:	108652
PubChem CID:	50253080
Reduced:	N5O5C31H35 (1)
Stoich.:	A5B5C31D35 (1)
Weight, g/mol:	555.284555
ΔH_f, kcal/mol:	-148.24
Dipole, Da:	2.82
IP(EA), eV:	-8.39(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2,5-dimethylanilino)-2-oxoethyl]-1-[2-[2-methyl-4-(phenylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)NC2=CC=CC=C2)NC(=O)CN3CCC(CC3)C(=O)NCC(=O)NC4=CC=CC=C4OC

DOS

IR

Vibrations