Geometry & MOs

Info

ID:	314279
PubChem CID:	126621140
Reduced:	FO2S2N6C20H21 (1)
Stoich.:	AB2C2D6E20F21 (1)
Weight, g/mol:	253.93747
ΔH_f, kcal/mol:	-20.23
Dipole, Da:	7.62
IP(EA), eV:	-9.52(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1S)-1-iodoethyl]-5-methyl-1,3,4-thiadiazole

Drug info:

PubChemData

Smile

CC(=O)NC1=NN=C(S1)[C@@H]2CC[C@@H](C2)CC3=NN=C(S3)NC(=O)CC4=CC=CC=C4F

DOS

IR

Vibrations