Geometry & MOs

Info

ID:

378945

PubChem CID:

134228463

Reduced:

FO2N7C25H30 (1)

Stoich.:

AB2C7D25E30 (1)

Weight, g/mol:

518.2554

ΔHf, kcal/mol:

-32.67

Dipole, Da:

3.67

IP(EA), eV:

 -8.93(-0.33)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[2-[2-(dimethylamino)ethyl-methylamino]-5-[[4-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCC[C@@H](CC1)N2C(=C(C(=N2)C3=CN(N=C3)CC4=CC=C(C=C4)F)C#N)N

DOS

IR

Vibrations