Geometry & MOs

Info

ID:	212694
PubChem CID:	81061548
Reduced:	N2O3C14H22 (1)
Stoich.:	A2B3C14D22 (1)
Weight, g/mol:	253.142641
ΔH_f, kcal/mol:	-121.14
Dipole, Da:	1.34
IP(EA), eV:	-8.02(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-2-[methyl(2-propan-2-yloxyethyl)amino]pyridine-4-carboxylic acid

Drug info:

PubChemData

Smile

CCOCCN(C)C1=CC(=C(C=C1)N)C(=O)OCC

DOS

IR

Vibrations