Geometry & MOs

Info

ID:	207600
PubChem CID:	80424182
Reduced:	ON2C16H32 (1)
Stoich.:	AB2C16D32 (1)
Weight, g/mol:	286.98569
ΔH_f, kcal/mol:	-80.37
Dipole, Da:	0.82
IP(EA), eV:	-8.8(2.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methylsulfonyl-2-(1,2,4-thiadiazol-5-ylsulfanyl)aniline

Drug info:

PubChemData

Smile

CC(C)CC1(CCCC1)CNCCC2COCCN2

DOS

IR

Vibrations