Geometry & MOs

Info

ID:	142219
PubChem CID:	53002216
Reduced:	SN3O3H19C23 (1)
Stoich.:	AB3C3D19E23 (1)
Weight, g/mol:	280.084792
ΔH_f, kcal/mol:	-13.85
Dipole, Da:	6.28
IP(EA), eV:	-8.88(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,3-benzodioxol-5-yl)-5-benzyl-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=CSC(=C2N3C=CC=C3)C(=O)NC4=CC=C(C=C4)C(=O)N

DOS

IR

Vibrations