Geometry & MOs

Info

ID:	38975
PubChem CID:	8138276
Reduced:	SN3O3H15C19 (1)
Stoich.:	AB3C3D15E19 (1)
Weight, g/mol:	371.01314
ΔH_f, kcal/mol:	-5.25
Dipole, Da:	4.03
IP(EA), eV:	-9.43(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl 1,3-benzothiazole-6-carboxylate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NN=C(O2)[C@H](C)OC(=O)C3=CC4=C(C=C3)N=CS4

DOS

IR

Vibrations