Geometry & MOs

Info

ID:

433671

PubChem CID:

135173811

Reduced:

SO3N5C32H35 (1)

Stoich.:

AB3C5D32E35 (1)

Weight, g/mol:

574.224787

ΔHf, kcal/mol:

-28.97

Dipole, Da:

4.25

IP(EA), eV:

 -8.17(-0.41)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[2-chloro-3-[3-[(3-ethenyl-1,7-naphthyridin-8-yl)amino]-2-methylphenyl]phenyl]-5-(pyrrolidin-1-ylmethyl)pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)C2=CC(=CC=C2)C(=O)N(C)C)SNC3=CC=CC(=C3)NC(=O)NC4=CC(=CC=C4)N(C)C

DOS

IR

Vibrations