Geometry & MOs

Info

ID:	149972
PubChem CID:	53789655
Reduced:	SN2F4O5H22C27 (1)
Stoich.:	AB2C4D5E22F27 (1)
Weight, g/mol:	379.078677
ΔH_f, kcal/mol:	-308.45
Dipole, Da:	2.56
IP(EA), eV:	-8.61(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-(4-chlorophenyl)-2-(2,6-difluorophenyl)-3,8,10-trioxa-1-azaspiro[5.5]undec-1-ene

Drug info:

PubChemData

Smile

C1C(C(C2=C(O1)C=CC(=C2)OCC3=NC4=CC=CC=C4C(=C3)F)O)CC5=CC(=CC=C5)NS(=O)(=O)C(F)(F)F

DOS

IR

Vibrations