Geometry & MOs

Info

ID:	324184
PubChem CID:	126677090
Reduced:	ClNO2H8C10 (1)
Stoich.:	ABC2D8E10 (1)
Weight, g/mol:	228.056863
ΔH_f, kcal/mol:	-11.24
Dipole, Da:	4.62
IP(EA), eV:	-9.74(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)thietane 1,1-dioxide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=NO2)C(O)Cl

DOS

IR

Vibrations