Geometry & MOs

Info

ID:	276735
PubChem CID:	103824845
Reduced:	ON4C8H10 (1)
Stoich.:	AB4C8D10 (1)
Weight, g/mol:	240.104482
ΔH_f, kcal/mol:	43.2
Dipole, Da:	1.56
IP(EA), eV:	-10.31(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-ethylsulfanylcyclopentyl)-1H-1,2,4-triazole-5-carboxamide

Drug info:

PubChemData

Smile

C#CCCCNC(=O)C1=NC=NN1

DOS

IR

Vibrations