Geometry & MOs

Info

ID:	430452
PubChem CID:	135170516
Reduced:	OSN2C10H10 (1)
Stoich.:	ABC2D10E10 (1)
Weight, g/mol:	206.051384
ΔH_f, kcal/mol:	27.69
Dipole, Da:	3.43
IP(EA), eV:	-8.94(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-methoxyphenyl)-5-methyl-1,2,4-thiadiazole

Drug info:

PubChemData

Smile

CC1=NC(=NS1)C2=CC=CC=C2OC

DOS

IR

Vibrations