Geometry & MOs

Info

ID:	68910
PubChem CID:	46511538
Reduced:	FN2O3H15C19 (1)
Stoich.:	AB2C3D15E19 (1)
Weight, g/mol:	499.15772
ΔH_f, kcal/mol:	-44.09
Dipole, Da:	5.33
IP(EA), eV:	-9.48(-1.04)
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 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidine-4-carboxylate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations