Geometry & MOs

Info

ID:	376317
PubChem CID:	134222327
Reduced:	F4O5C23H24 (1)
Stoich.:	A4B5C23D24 (1)
Weight, g/mol:	426.161821
ΔH_f, kcal/mol:	-365.94
Dipole, Da:	6.27
IP(EA), eV:	-9.75(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[difluoro-[4-(4-propylcyclohexen-1-yl)phenyl]methoxy]-1,3-difluoro-2-(fluoromethoxy)benzene

Drug info:

PubChemData

Smile

CCCCCC1COC(OC1)C2=CC(=C(C=C2)C(=O)OC3=CC(=C(C(=C3)F)OCF)F)F

DOS

IR

Vibrations