Geometry & MOs

Info

ID:	285912
PubChem CID:	104137092
Reduced:	NOC8H13 (2)
Stoich.:	ABC8D13 (2)
Weight, g/mol:	250.168128
ΔH_f, kcal/mol:	-106.7
Dipole, Da:	5.45
IP(EA), eV:	-8.84(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-6-(4-methylpentan-2-ylamino)pyridine-4-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)CC(C)NC1=CC(=CC(=N1)C(C)(C)C)C(=O)O

DOS

IR

Vibrations