Geometry & MOs

Info

ID:	234503
PubChem CID:	92298567
Reduced:	N2S2O3C6H12 (1)
Stoich.:	A2B2C3D6E12 (1)
Weight, g/mol:	285.94453
ΔH_f, kcal/mol:	-124.66
Dipole, Da:	6.72
IP(EA), eV:	-9.44(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R,4R)-4-bromo-3-methyl-1,1-dioxothiolan-3-yl] carbamimidothioate

Drug info:

PubChemData

Smile

C[C@]1(CS(=O)(=O)C[C@@H]1SC(=N)N)O

DOS

IR

Vibrations