Geometry & MOs

Info

ID:	184113
PubChem CID:	77111618
Reduced:	FOSN2H11C13 (1)
Stoich.:	ABCD2E11F13 (1)
Weight, g/mol:	303.93397
ΔH_f, kcal/mol:	-5.77
Dipole, Da:	4.32
IP(EA), eV:	-8.87(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-bromophenyl)sulfanylmethyl]-1,2,4-oxadiazolidine-5-thione

Drug info:

PubChemData

Smile

CC1=NC(=NC(=O)C1=C)CSC2=CC=CC=C2F

DOS

IR

Vibrations