Geometry & MOs

Info

ID:	68901
PubChem CID:	46511451
Reduced:	FN2O5H21C22 (1)
Stoich.:	AB2C5D21E22 (1)
Weight, g/mol:	433.11077
ΔH_f, kcal/mol:	-148.23
Dipole, Da:	7.08
IP(EA), eV:	-9.47(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-(propan-2-ylsulfamoyl)benzoate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C2=NOC(=N2)COC(=O)C3=CC=C(C=C3)OCC4CCCO4)F

DOS

IR

Vibrations