Geometry & MOs

Info

ID:	250406
PubChem CID:	103096356
Reduced:	SN2O3C10H12 (1)
Stoich.:	AB2C3D10E12 (1)
Weight, g/mol:	200.116092
ΔH_f, kcal/mol:	-38.73
Dipole, Da:	3.7
IP(EA), eV:	-9.01(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-(3-methoxypropyl)-1,2,4-oxadiazol-3-yl]propan-1-ol

Drug info:

PubChemData

Smile

CCC(C1=NOC(=N1)C2=CC(=CS2)OC)O

DOS

IR

Vibrations