Geometry & MOs

Info

ID:	63815
PubChem CID:	26759246
Reduced:	ClSN2O4C17H21 (1)
Stoich.:	ABC2D4E17F21 (1)
Weight, g/mol:	365.989962
ΔH_f, kcal/mol:	-173.39
Dipole, Da:	3.88
IP(EA), eV:	-8.62(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 2-chloro-5-methylsulfanylbenzoate

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC(=O)NC1CCCC1)OC(=O)C2=C(C=CC(=C2)SC)Cl

DOS

IR

Vibrations