Geometry & MOs

Info

ID:	207361
PubChem CID:	80387053
Reduced:	OF3N4C13H19 (1)
Stoich.:	AB3C4D13E19 (1)
Weight, g/mol:	266.174276
ΔH_f, kcal/mol:	-185.64
Dipole, Da:	6.26
IP(EA), eV:	-9.62(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-cyclopentyloxyethyl)-5-propan-2-yl-1H-1,2,4-triazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=NC(=NN1)C(=O)N2CCC(CC2)C(F)(F)F

DOS

IR

Vibrations