Geometry & MOs

Info

ID:	371985
PubChem CID:	131284096
Reduced:	ClON2H5C9 (1)
Stoich.:	ABC2D5E9 (1)
Weight, g/mol:	202.037842
ΔH_f, kcal/mol:	45.18
Dipole, Da:	1.17
IP(EA), eV:	-10.66(-1.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(cyanomethyl)furo[2,3-b]pyridine-2-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC(=NC=C1C#N)C(=O)/C=C/Cl

DOS

IR

Vibrations