Geometry & MOs

Info

ID:	247205
PubChem CID:	103068705
Reduced:	N3S3C8H13 (1)
Stoich.:	A3B3C8D13 (1)
Weight, g/mol:	233.011511
ΔH_f, kcal/mol:	74.12
Dipole, Da:	2.05
IP(EA), eV:	-8.54(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]prop-2-en-1-amine

Drug info:

PubChemData

Smile

CNCC(=C)CSC1=NN=C(S1)SC

DOS

IR

Vibrations