Geometry & MOs

Info

ID:	34346
PubChem CID:	7890868
Reduced:	SN2O3H22C23 (1)
Stoich.:	AB2C3D22E23 (1)
Weight, g/mol:	380.056385
ΔH_f, kcal/mol:	-72.41
Dipole, Da:	8.9
IP(EA), eV:	-8.39(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)SC2=CC=C(C=C2)NC(=O)COC(=O)C3=CC=C(C=C3)N

DOS

IR

Vibrations