Geometry & MOs

Info

ID:	285737
PubChem CID:	104123411
Reduced:	N2O2C15H22 (1)
Stoich.:	A2B2C15D22 (1)
Weight, g/mol:	252.147393
ΔH_f, kcal/mol:	-87.55
Dipole, Da:	5.74
IP(EA), eV:	-8.9(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[butyl(2-hydroxyethyl)amino]-6-methylpyridine-4-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC(=CC(=N1)NC2CCCCCCC2)C(=O)O

DOS

IR

Vibrations