Geometry & MOs

Info

ID:	211748
PubChem CID:	81053151
Reduced:	N2O2C15H24 (1)
Stoich.:	A2B2C15D24 (1)
Weight, g/mol:	291.066221
ΔH_f, kcal/mol:	-111.59
Dipole, Da:	6.27
IP(EA), eV:	-9.24(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-chloro-3-methylphenoxy)-2,6-dimethylpyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

CCC(CC)C(C)NC1=C(C(=NC(=C1)C)C)C(=O)O

DOS

IR

Vibrations