Geometry & MOs

Info

ID:	376308
PubChem CID:	134222318
Reduced:	O2F5H19C24 (1)
Stoich.:	A2B5C19D24 (1)
Weight, g/mol:	484.127327
ΔH_f, kcal/mol:	-252.75
Dipole, Da:	4.59
IP(EA), eV:	-9.47(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3,5-difluoro-4-(fluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluoro-5-[4-[(E)-pent-3-enyl]phenyl]benzene

Drug info:

PubChemData

Smile

C=CCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(OC3=CC(=C(C(=C3)F)OCF)F)(F)F

DOS

IR

Vibrations