Geometry & MOs

Info

ID:	376360
PubChem CID:	134222371
Reduced:	O2F6H28C29 (1)
Stoich.:	A2B6C28D29 (1)
Weight, g/mol:	535.138226
ΔH_f, kcal/mol:	-345.39
Dipole, Da:	5.76
IP(EA), eV:	-9.13(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[[4-[3,5-difluoro-4-(fluoromethoxy)phenyl]-3-fluorophenoxy]-difluoromethyl]-3-fluorophenyl]-5-propylpyridine

Drug info:

PubChemData

Smile

CCCC1CCC(CC1)C2=CC(=C(C=C2)C(OC3=CC(=C(C=C3)C4=CC(=C(C=C4)OCF)F)F)(F)F)F

DOS

IR

Vibrations