Geometry & MOs

Info

ID:	343449
PubChem CID:	127266622
Reduced:	N2O3C13H14 (1)
Stoich.:	A2B3C13D14 (1)
Weight, g/mol:	309.147727
ΔH_f, kcal/mol:	-78.94
Dipole, Da:	4.86
IP(EA), eV:	-9.85(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,3-dihydro-1-benzofuran-5-yl)-N-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)prop-2-enamide

Drug info:

PubChemData

Smile

COC(=O)C1=CCCN(C1)C(=O)C2=CN=CC=C2

DOS

IR

Vibrations