Geometry & MOs

Info

ID:	285926
PubChem CID:	104138110
Reduced:	N2O2C13H18 (1)
Stoich.:	A2B2C13D18 (1)
Weight, g/mol:	262.168128
ΔH_f, kcal/mol:	-68.6
Dipole, Da:	5.07
IP(EA), eV:	-8.98(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-methylcyclopentyl)amino]-6-propylpyridine-4-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)C1=NC(=CC(=C1)C(=O)O)NC2CCC2

DOS

IR

Vibrations