Geometry & MOs

Info

ID:

116095

PubChem CID:

50546442

Reduced:

Cl2O5N6C29H34 (1)

Stoich.:

A2B5C6D29E34 (1)

Weight, g/mol:

649.198938

ΔHf, kcal/mol:

-194.93

Dipole, Da:

7.06

IP(EA), eV:

 -9.0(-1.04)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[2-[4-chloro-3-(piperidine-1-carbonyl)anilino]-2-oxoethyl]-N-[1-(2,5-dichloroanilino)-3-methyl-1-oxobutan-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)C1=C(C=CC(=C1)Cl)NC(=O)CNC(=O)C2CCN(CC2)CC(=O)NC3=CC(=C(C=C3)Cl)C(=O)N4CCCC4

DOS

IR

Vibrations