Geometry & MOs

Info

ID:	27766
PubChem CID:	823473
Reduced:	O2N5C12H19 (1)
Stoich.:	A2B5C12D19 (1)
Weight, g/mol:	348.97121
ΔH_f, kcal/mol:	-72.1
Dipole, Da:	6.43
IP(EA), eV:	-8.77(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-iodophenyl)-3-pyridin-3-yl-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CC(C)CCN1C2=C(N=C1NC)N(C(=O)NC2=O)C

DOS

IR

Vibrations