Geometry & MOs

Info

ID:	259779
PubChem CID:	103174197
Reduced:	O2N3C14H23 (1)
Stoich.:	A2B3C14D23 (1)
Weight, g/mol:	272.116092
ΔH_f, kcal/mol:	-51.73
Dipole, Da:	3.31
IP(EA), eV:	-8.8(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(2-ethyl-6-methylpyridin-3-yl)oxymethyl]pyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

CC1(CN(CCN1)CC2=NC=CC(=C2OC)OC)C

DOS

IR

Vibrations