Geometry & MOs

Info

ID:	376796
PubChem CID:	134222822
Reduced:	O2F7H25C28 (1)
Stoich.:	A2B7C25D28 (1)
Weight, g/mol:	542.149205
ΔH_f, kcal/mol:	-376.2
Dipole, Da:	8.09
IP(EA), eV:	-9.57(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-difluorophenyl)-5-[[4-[4-(ethoxymethyl)cyclohexen-1-yl]-2,6-difluorophenyl]-difluoromethoxy]-1,3-difluorobenzene

Drug info:

PubChemData

Smile

CCOCC1CCC(CC1)C2=C(C(=C(C=C2)C(OC3=CC(=C(C=C3)C4=CC(=C(C=C4)F)F)F)(F)F)F)F

DOS

IR

Vibrations