Geometry & MOs

Info

ID:	447719
PubChem CID:	135285084
Reduced:	SF2N2O4H20C22 (1)
Stoich.:	AB2C2D4E20F22 (1)
Weight, g/mol:	262.168128
ΔH_f, kcal/mol:	-187.68
Dipole, Da:	6.84
IP(EA), eV:	-8.32(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N-cyclohexylbicyclo[2.2.1]hept-1(6)-ene-2,3-dicarboxamide

Drug info:

PubChemData

Smile

CC1=C2C(=C(N1)C3=C(C=CC(=C3)CNS(=O)O)OC4=C(C=C(C=C4)F)F)CCCC2=O

DOS

IR

Vibrations