Geometry & MOs

Info

ID:	208949
PubChem CID:	80607055
Reduced:	ClSN3O4H8C10 (1)
Stoich.:	ABC3D4E8F10 (1)
Weight, g/mol:	204.012412
ΔH_f, kcal/mol:	5.79
Dipole, Da:	4.34
IP(EA), eV:	-9.59(-1.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-5-(cyclobutyloxymethyl)-1,3,4-thiadiazole

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)[N+](=O)[O-])OCC2=NN=C(S2)Cl

DOS

IR

Vibrations