Geometry & MOs

Info

ID:	277200
PubChem CID:	103827272
Reduced:	ClN2O2C9H11 (1)
Stoich.:	AB2C2D9E11 (1)
Weight, g/mol:	214.050905
ΔH_f, kcal/mol:	-77.0
Dipole, Da:	3.77
IP(EA), eV:	-8.86(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propyl 5-amino-2-chloropyridine-4-carboxylate

Drug info:

PubChemData

Smile

CC(C)OC(=O)C1=CC(=NC=C1N)Cl

DOS

IR

Vibrations