Geometry & MOs

Info

ID:

432401

PubChem CID:

135172534

Reduced:

Cl2O2N8C35H40 (1)

Stoich.:

A2B2C8D35E40 (1)

Weight, g/mol:

660.249478

ΔHf, kcal/mol:

-5.86

Dipole, Da:

4.86

IP(EA), eV:

 -8.74(-0.44)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[2-chloro-3-[2-chloro-3-[(5-cyclobutyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carbonyl)amino]phenyl]phenyl]-5-ethyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CCN1CCC2=C(C1)N=C(N2C)C(=O)NC3=CC=CC(=C3Cl)C4=C(C(=CC=C4)NC(=O)C5=NC6=C(N5C)CCN(C6)C7CCCC7)Cl

DOS

IR

Vibrations