Geometry & MOs

Info

ID:	31552
PubChem CID:	855862
Reduced:	SN2O3H12C16 (1)
Stoich.:	AB2C3D12E16 (1)
Weight, g/mol:	318.103814
ΔH_f, kcal/mol:	-7.77
Dipole, Da:	8.52
IP(EA), eV:	-8.89(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclohexyl-[5-(4-methoxyphenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methanone

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=NN(C(=S)O2)C(=O)C3=CC=CC=C3

DOS

IR

Vibrations