Geometry & MOs

Info

ID:	277969
PubChem CID:	103832268
Reduced:	NO4C17H23 (1)
Stoich.:	AB4C17D23 (1)
Weight, g/mol:	243.137162
ΔH_f, kcal/mol:	-191.15
Dipole, Da:	6.63
IP(EA), eV:	-9.74(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-ethylphenyl)-5-[(2R)-pyrrolidin-2-yl]-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CC1CCC(C2=CC=CC=C12)(C(=O)O)NC(=O)OC(C)(C)C

DOS

IR

Vibrations