Geometry & MOs

Info

ID:	31553
PubChem CID:	855863
Reduced:	SN2O3C16H18 (1)
Stoich.:	AB2C3D16E18 (1)
Weight, g/mol:	341.083413
ΔH_f, kcal/mol:	-62.13
Dipole, Da:	6.26
IP(EA), eV:	-8.83(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[5-(3-hydroxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(2-methylphenyl)acetamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=NN(C(=S)O2)C(=O)C3CCCCC3

DOS

IR

Vibrations