Geometry & MOs

Info

ID:	233342
PubChem CID:	89850278
Reduced:	O2F7C23H27 (1)
Stoich.:	A2B7C23D27 (1)
Weight, g/mol:	518.186734
ΔH_f, kcal/mol:	-455.47
Dipole, Da:	4.84
IP(EA), eV:	-9.82(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[4-[difluoro-(4-propylcyclohexyl)methoxy]cyclohexen-1-yl]-difluoromethoxy]-1,3-difluoro-2-(trifluoromethyl)benzene

Drug info:

PubChemData

Smile

CCCC1CCC(CC1)C(OC2CCC(=CC2)C(OC3=CC(=C(C(=C3)F)F)F)(F)F)(F)F

DOS

IR

Vibrations