Geometry & MOs

Info

ID:	272143
PubChem CID:	103727664
Reduced:	ON4C11H12 (1)
Stoich.:	AB4C11D12 (1)
Weight, g/mol:	228.101111
ΔH_f, kcal/mol:	93.8
Dipole, Da:	10.05
IP(EA), eV:	-9.28(-1.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5E)-5-(3-cyclopentyl-2H-1,2,4-oxadiazol-5-ylidene)pyrrole-3-carbonitrile

Drug info:

PubChemData

Smile

CCCCC1=N/C(=C\2/C=C(C=N2)C#N)/ON1

DOS

IR

Vibrations