Geometry & MOs

Info

ID:	285717
PubChem CID:	104121691
Reduced:	O2N3C12H13 (1)
Stoich.:	A2B3C12D13 (1)
Weight, g/mol:	257.105193
ΔH_f, kcal/mol:	-29.73
Dipole, Da:	3.49
IP(EA), eV:	-9.52(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-dimethylphenoxy)-6-methylpyridine-4-carboxylic acid

Drug info:

PubChemData

Smile

CCC1=NC=CN1C2=NC(=CC(=C2)C(=O)O)C

DOS

IR

Vibrations