Geometry & MOs

Info

ID:	277999
PubChem CID:	103832566
Reduced:	O2N3C11H21 (1)
Stoich.:	A2B3C11D21 (1)
Weight, g/mol:	289.142641
ΔH_f, kcal/mol:	-48.02
Dipole, Da:	4.24
IP(EA), eV:	-9.74(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCC[C@@H](C1=NC(=NO1)CCCOC)N

DOS

IR

Vibrations