Geometry & MOs

Info

ID:	207609
PubChem CID:	80426541
Reduced:	FON2S2H7C10 (1)
Stoich.:	ABC2D2E7F10 (1)
Weight, g/mol:	237.03944
ΔH_f, kcal/mol:	-3.7
Dipole, Da:	4.36
IP(EA), eV:	-9.36(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations