Geometry & MOs

Info

ID:	191535
PubChem CID:	78160399
Reduced:	FCl2N4O4H21C22 (1)
Stoich.:	AB2C4D4E21F22 (1)
Weight, g/mol:	422.203942
ΔH_f, kcal/mol:	-133.29
Dipole, Da:	3.41
IP(EA), eV:	-8.22(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-N-(6-oxo-11-propyl-5-azatricyclo[8.4.0.01,5]tetradecan-12-yl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC(C1=C(C=CC(=C1Cl)F)Cl)OC2=C(N=CC(=C2)C3=CN(N=C3)C4COC5C4OCC5O)N

DOS

IR

Vibrations