Geometry & MOs

Info

ID:	26468
PubChem CID:	649442
Reduced:	OS2N5C11H15 (1)
Stoich.:	AB2C5D11E15 (1)
Weight, g/mol:	244.030649
ΔH_f, kcal/mol:	48.75
Dipole, Da:	4.77
IP(EA), eV:	-9.25(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-sulfanyl-1,3,4-oxadiazol-2-yl)naphthalen-2-ol

Drug info:

PubChemData

Smile

CC(C)N1C(=NN=N1)SCC(=O)NCC2=CC=CS2

DOS

IR

Vibrations