Geometry & MOs

Info

ID:	376731
PubChem CID:	134222756
Reduced:	O2F5C21H21 (1)
Stoich.:	A2B5C21D21 (1)
Weight, g/mol:	498.14412
ΔH_f, kcal/mol:	-300.57
Dipole, Da:	7.22
IP(EA), eV:	-9.77(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(difluoromethoxy)-5-[[4-[4-(ethoxymethyl)cyclohexyl]-2,6-difluorophenyl]-difluoromethoxy]-1,3-difluorobenzene

Drug info:

PubChemData

Smile

COCC1CCC(CC1)C2=CC=C(C=C2)C(OC3=CC(=C(C(=C3)F)F)F)(F)F

DOS

IR

Vibrations