Geometry & MOs

Info

ID:	276733
PubChem CID:	103824842
Reduced:	OSN4C9H14 (1)
Stoich.:	ABC4D9E14 (1)
Weight, g/mol:	226.088832
ΔH_f, kcal/mol:	-2.77
Dipole, Da:	0.68
IP(EA), eV:	-8.73(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CSC1CCCC1NC(=O)C2=NC=NN2

DOS

IR

Vibrations