Geometry & MOs

Info

ID:	207637
PubChem CID:	80430045
Reduced:	FS2N3C12H14 (1)
Stoich.:	AB2C3D12E14 (1)
Weight, g/mol:	238.023455
ΔH_f, kcal/mol:	19.41
Dipole, Da:	2.94
IP(EA), eV:	-9.0(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(1,2,4-thiadiazol-5-ylsulfanyl)phenyl]ethanol

Drug info:

PubChemData

Smile

CCNCC1=C(C=CC(=C1)F)SC2=NC(=NS2)C

DOS

IR

Vibrations