Geometry & MOs

Info

ID:

107359

PubChem CID:

50199943

Reduced:

O5N6C34H48 (1)

Stoich.:

A5B6C34D48 (1)

Weight, g/mol:

612.282696

ΔHf, kcal/mol:

-234.98

Dipole, Da:

3.96

IP(EA), eV:

 -8.71(-0.15)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[2-[5-chloro-2-(dimethylcarbamoyl)anilino]-2-oxoethyl]-1-[2-[4-(diethylcarbamoyl)-2-methylanilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCC(C)NC(=O)C1=CC(=C(C=C1)NC(=O)C(C)N2CCC(CC2)C(=O)NC(C(C)C)C(=O)NC3=CC=CC=C3C(=O)NC)C

DOS

IR

Vibrations