Geometry & MOs

Info

ID:	211733
PubChem CID:	81051666
Reduced:	NOC8H12 (2)
Stoich.:	ABC8D12 (2)
Weight, g/mol:	272.127326
ΔH_f, kcal/mol:	-103.95
Dipole, Da:	4.81
IP(EA), eV:	-9.28(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-4-[(2-methylpyrimidin-4-yl)methylamino]pyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations