Geometry & MOs

Info

ID:	372803
PubChem CID:	131305075
Reduced:	N2O2H8C11 (1)
Stoich.:	A2B2C8D11 (1)
Weight, g/mol:	200.058578
ΔH_f, kcal/mol:	-17.82
Dipole, Da:	4.96
IP(EA), eV:	-9.39(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(cyanomethyl)indolizine-1-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC2=C(C=C1C(=O)O)C=C(N2)CC#N

DOS

IR

Vibrations