Geometry & MOs

Info

ID:	268389
PubChem CID:	103599222
Reduced:	O3N5C25H25 (1)
Stoich.:	A3B5C25D25 (1)
Weight, g/mol:	424.166604
ΔH_f, kcal/mol:	20.07
Dipole, Da:	2.87
IP(EA), eV:	-8.15(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-chloroimidazo[1,2-a]pyridin-3-yl)-1-[4-[1-(3-methoxyphenyl)ethyl]piperazin-1-yl]prop-2-en-1-one

Drug info:

PubChemData

Smile

CN1C=CN=C1CNC(=O)C=CC2=CN(N=C2C3=CC(=C(C=C3)OC)OC)C4=CC=CC=C4

DOS

IR

Vibrations