Geometry & MOs

Info

ID:	130597
PubChem CID:	51091501
Reduced:	O2N4C15H18 (1)
Stoich.:	A2B4C15D18 (1)
Weight, g/mol:	327.133139
ΔH_f, kcal/mol:	-5.8
Dipole, Da:	5.0
IP(EA), eV:	-8.77(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methoxy-N-[3-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)propyl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

C/C=C/C=C/C(=O)NCCCN1C(=O)N2C=CC=CC2=N1

DOS

IR

Vibrations