Geometry & MOs

Info

ID:	376371
PubChem CID:	134222383
Reduced:	O2F5C23H31 (1)
Stoich.:	A2B5C23D31 (1)
Weight, g/mol:	546.236877
ΔH_f, kcal/mol:	-365.28
Dipole, Da:	3.95
IP(EA), eV:	-9.67(-0.61)
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-(4-propylcyclohexyl)cyclohexyl]benzene

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations