Geometry & MOs

Info

ID:	85390
PubChem CID:	49874706
Reduced:	N2O3C10H10 (1)
Stoich.:	A2B3C10D10 (1)
Weight, g/mol:	282.100442
ΔH_f, kcal/mol:	-67.2
Dipole, Da:	4.24
IP(EA), eV:	-9.96(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-amino-6-methoxy-4-methylfuro[2,3-b]pyridin-2-yl)-phenylmethanone

Drug info:

PubChemData

Smile

CC1=CC(=NC(=C1C#N)C(=O)OC)OC

DOS

IR

Vibrations