Geometry & MOs

Info

ID:	376762
PubChem CID:	134222788
Reduced:	ClO2F7H24C28 (1)
Stoich.:	AB2C7D24E28 (1)
Weight, g/mol:	476.158627
ΔH_f, kcal/mol:	-382.86
Dipole, Da:	9.07
IP(EA), eV:	-9.73(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[4-(but-3-enoxymethyl)cyclohexyl]-2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-1,3-difluorobenzene

Drug info:

PubChemData

Smile

CCOCC1CCC(CC1)C2=CC(=C(C=C2)C3=C(C(=C(C=C3)C(OC4=CC(=C(C(=C4)F)F)F)(F)F)F)Cl)F

DOS

IR

Vibrations