Geometry & MOs

Info

ID:	209083
PubChem CID:	80620977
Reduced:	OSN3C15H17 (1)
Stoich.:	ABC3D15E17 (1)
Weight, g/mol:	305.119798
ΔH_f, kcal/mol:	41.19
Dipole, Da:	0.57
IP(EA), eV:	-8.65(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[3-(thian-2-yl)-1,2,4-oxadiazol-5-yl]anilino]ethanol

Drug info:

PubChemData

Smile

C1CCSC(C1)C2=NOC(=N2)C3CNC4=CC=CC=C34

DOS

IR

Vibrations