Geometry & MOs

Info

ID:	25353
PubChem CID:	623498
Reduced:	SiO5C24H48 (1)
Stoich.:	AB5C24D48 (1)
Weight, g/mol:	273.030504
ΔH_f, kcal/mol:	-360.86
Dipole, Da:	3.37
IP(EA), eV:	-9.63(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1,3-benzodioxol-5-yl)-5-chloro-[1,2,4]triazolo[4,3-a]pyridine

Drug info:

PubChemData

Smile

CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC)O[Si](C)(C)C

DOS

IR

Vibrations