Geometry & MOs

Info

ID:	335892
PubChem CID:	127254754
Reduced:	ON5C22H29 (1)
Stoich.:	AB5C22D29 (1)
Weight, g/mol:	293.112404
ΔH_f, kcal/mol:	26.73
Dipole, Da:	1.24
IP(EA), eV:	-8.54(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-(methoxymethyl)-1H-1,2,4-triazol-3-yl]-2-[(6-methyl-4-oxo-1H-pyridin-3-yl)oxy]acetamide

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2N=C1N3CCN(CC3)C(=O)CCCCCN4C=CC=C4

DOS

IR

Vibrations