Geometry & MOs

Info

ID:

433599

PubChem CID:

135173739

Reduced:

ClON7C33H34 (1)

Stoich.:

ABC7D33E34 (1)

Weight, g/mol:

576.204052

ΔHf, kcal/mol:

63.51

Dipole, Da:

1.92

IP(EA), eV:

 -8.15(-0.71)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=CN=C2C(=C1)C=CN=C2NC3=CC=CC(=C3C)C4=C(C(=CC=C4)NC(=O)C5=NC6=C(N5C)CCN(C6)CC)Cl

DOS

IR

Vibrations