Geometry & MOs

Info

ID:	376370
PubChem CID:	134222382
Reduced:	N2O2F8H18C27 (1)
Stoich.:	A2B2C8D18E27 (1)
Weight, g/mol:	434.224421
ΔH_f, kcal/mol:	-365.88
Dipole, Da:	10.79
IP(EA), eV:	-9.61(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCC1=CN=C(N=C1)C2=CC(=C(C=C2)C3=CC(=C(C(=C3)F)C(OC4=CC(=C(C(=C4)F)OCF)F)(F)F)F)F

DOS

IR

Vibrations