Geometry & MOs

Info

ID:	376325
PubChem CID:	134222336
Reduced:	O2F6C23H24 (1)
Stoich.:	A2B6C23D24 (1)
Weight, g/mol:	464.158627
ΔH_f, kcal/mol:	-363.36
Dipole, Da:	6.66
IP(EA), eV:	-9.6(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3,5-difluoro-4-(fluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluoro-5-(4-propylcyclohexyl)benzene

Drug info:

PubChemData

Smile

CCCC1CCC(CC1)C2=CC(=C(C=C2)C(OC3=CC(=C(C(=C3)F)OCF)F)(F)F)F

DOS

IR

Vibrations