Geometry & MOs

Info

ID:	376300
PubChem CID:	134222310
Reduced:	O2F4C23H32 (1)
Stoich.:	A2B4C23D32 (1)
Weight, g/mol:	418.193121
ΔH_f, kcal/mol:	-320.34
Dipole, Da:	2.23
IP(EA), eV:	-9.04(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[4-(4-ethenylcyclohexyl)cyclohexyl]-difluoromethoxy]-1,3-difluoro-2-(fluoromethoxy)benzene

Drug info:

PubChemData

Smile

CCCC1CCC(CC1)C2CCC(CC2)C(OC3=CC(=C(C=C3)OCF)F)(F)F

DOS

IR

Vibrations