Geometry & MOs

Info

ID:	264523
PubChem CID:	103466979
Reduced:	SN3C15H21 (1)
Stoich.:	AB3C15D21 (1)
Weight, g/mol:	293.210327
ΔH_f, kcal/mol:	32.38
Dipole, Da:	4.66
IP(EA), eV:	-8.43(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2R,4S)-4-methoxypyrrolidin-2-yl]-3-(4-propan-2-ylcyclohexyl)-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CCC(C)(C)CNC1=C(C(=NS1)N)C2=CC=CC=C2

DOS

IR

Vibrations