Geometry & MOs

Info

ID:	233336
PubChem CID:	89850272
Reduced:	O3F9C27H29 (1)
Stoich.:	A3B9C27D29 (1)
Weight, g/mol:	580.147154
ΔH_f, kcal/mol:	-595.25
Dipole, Da:	8.15
IP(EA), eV:	-9.97(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(4-butylcyclohexyl)-difluoromethoxy]-2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluorobenzene

Drug info:

PubChemData

Smile

CCCCCCC1CCC(CC1)C(OC2=CC=C(C=C2)C(OC3=CC(=C(C(=C3)F)OC(F)(F)F)F)(F)F)(F)F

DOS

IR

Vibrations