Geometry & MOs

Info

ID:	108668
PubChem CID:	50253585
Reduced:	N5O5C32H37 (1)
Stoich.:	A5B5C32D37 (1)
Weight, g/mol:	561.214282
ΔH_f, kcal/mol:	-159.53
Dipole, Da:	4.75
IP(EA), eV:	-8.69(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-chloroanilino)-2-oxoethyl]-1-[2-[2-methyl-4-(phenylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1NC(=O)CNC(=O)C2CCN(CC2)CC(=O)NC3=C(C=C(C=C3)C(=O)NC4=CC=CC=C4)C

DOS

IR

Vibrations