Geometry & MOs

Info

ID:	355519
PubChem CID:	127288582
Reduced:	SO3N4C15H24 (1)
Stoich.:	AB3C4D15E24 (1)
Weight, g/mol:	306.205576
ΔH_f, kcal/mol:	-49.44
Dipole, Da:	5.21
IP(EA), eV:	-9.0(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopropyl-5-[1-[4-(oxolan-3-ylmethyl)piperazin-1-yl]ethyl]-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CC(C1=NC(=NO1)C2CC2)N3CCN(CC3)C4CCS(=O)(=O)C4

DOS

IR

Vibrations