Geometry & MOs

Info

ID:	376333
PubChem CID:	134222344
Reduced:	O2F7H21C29 (1)
Stoich.:	A2B7C21D29 (1)
Weight, g/mol:	428.177471
ΔH_f, kcal/mol:	-344.48
Dipole, Da:	8.59
IP(EA), eV:	-9.39(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations