Geometry & MOs

Info

ID:	198824
PubChem CID:	79156552
Reduced:	N3O3C15H17 (1)
Stoich.:	A3B3C15D17 (1)
Weight, g/mol:	273.100108
ΔH_f, kcal/mol:	-2.37
Dipole, Da:	6.83
IP(EA), eV:	-9.69(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methyl-3-(2-phenoxyethoxy)pyridine-2-carboxylic acid

Drug info:

PubChemData

Smile

CC1=NC(=C(C=C1)OCC2=C(C(=CC=C2)[N+](=O)[O-])C)CN

DOS

IR

Vibrations