Geometry & MOs

Info

ID:	376382
PubChem CID:	134222394
Reduced:	F4O5H20C21 (1)
Stoich.:	A4B5C20D21 (1)
Weight, g/mol:	512.15977
ΔH_f, kcal/mol:	-357.55
Dipole, Da:	5.98
IP(EA), eV:	-9.67(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[4-[difluoro-(4-propylcyclohexyl)methoxy]-2-fluorophenyl]-difluoromethoxy]-1,3-difluoro-2-(fluoromethoxy)benzene

Drug info:

PubChemData

Smile

CCCC1COC(OC1)C2=CC(=C(C=C2)C(=O)OC3=CC(=C(C(=C3)F)OCF)F)F

DOS

IR

Vibrations