Geometry & MOs

Info

ID:	272195
PubChem CID:	103734485
Reduced:	ON3C13H27 (1)
Stoich.:	AB3C13D27 (1)
Weight, g/mol:	267.046633
ΔH_f, kcal/mol:	-54.9
Dipole, Da:	2.35
IP(EA), eV:	-8.93(1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]thiophene-2-carbonitrile

Drug info:

PubChemData

Smile

CCOC1CC(C1(C)C)NC(=NCC(C)C)N

DOS

IR

Vibrations