Geometry & MOs

Info

ID:	233340
PubChem CID:	89850276
Reduced:	NO2F8H23C25 (1)
Stoich.:	AB2C8D23E25 (1)
Weight, g/mol:	564.222977
ΔH_f, kcal/mol:	-448.88
Dipole, Da:	11.9
IP(EA), eV:	-10.17(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-chloro-4-[[4-[difluoro-(4-nonylcyclohexyl)methoxy]-2-fluorophenyl]-difluoromethoxy]-2-fluorobenzene

Drug info:

PubChemData

Smile

CCCCC1CCC(CC1)C(OC2=CC(=C(C(=C2)F)C(OC3=CC(=C(C(=C3)F)C#N)F)(F)F)F)(F)F

DOS

IR

Vibrations