Geometry & MOs

Info

ID:	350911
PubChem CID:	127279199
Reduced:	O2N5C16H19 (1)
Stoich.:	A2B5C16D19 (1)
Weight, g/mol:	287.126991
ΔH_f, kcal/mol:	50.61
Dipole, Da:	6.92
IP(EA), eV:	-9.01(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[2-(1,3-benzodioxol-5-yl)pyrrolidin-1-yl]methyl]-3-methyl-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

C1CC(N(C1)CC2=NN=NN2C3CC3)C4=CC5=C(C=C4)OCO5

DOS

IR

Vibrations