Geometry & MOs

Info

ID:	350876
PubChem CID:	127279164
Reduced:	O2N3C18H31 (1)
Stoich.:	A2B3C18D31 (1)
Weight, g/mol:	327.158292
ΔH_f, kcal/mol:	-113.73
Dipole, Da:	3.74
IP(EA), eV:	-9.21(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C(=O)N1CCCCC1)NC(=O)CN2CCCC2C3CCC3

DOS

IR

Vibrations