Geometry & MOs

Info

ID:	31565
PubChem CID:	855877
Reduced:	SN3O3H15C17 (1)
Stoich.:	AB3C3D15E17 (1)
Weight, g/mol:	318.022977
ΔH_f, kcal/mol:	-30.14
Dipole, Da:	1.89
IP(EA), eV:	-8.65(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]phenol

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC(=O)CSC2=NN=C(O2)C3=CC(=CC=C3)O

DOS

IR

Vibrations