Geometry & MOs

Info

ID:	277985
PubChem CID:	103832438
Reduced:	OSN3C11H19 (1)
Stoich.:	ABC3D11E19 (1)
Weight, g/mol:	277.142641
ΔH_f, kcal/mol:	2.65
Dipole, Da:	2.13
IP(EA), eV:	-8.78(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]butan-1-amine

Drug info:

PubChemData

Smile

CSCC[C@@H](C1=NC(=NO1)C2CCCC2)N

DOS

IR

Vibrations