Geometry & MOs

Info

ID:	444799
PubChem CID:	135263597
Reduced:	OH9C10 (2)
Stoich.:	AB9C10 (2)
Weight, g/mol:	437.186318
ΔH_f, kcal/mol:	-20.83
Dipole, Da:	1.56
IP(EA), eV:	-8.75(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(7E)-7-(2-fluoro-6-oxocyclohexa-2,4-dien-1-ylidene)-6-methyl-3-(4-prop-2-enoylpiperazin-1-yl)-1H-imidazo[1,2-a]pyridin-2-yl]acetamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)[C@H](CC2=CC=C(C=C2)O)C3=CC=C(C=C3)O

DOS

IR

Vibrations