Geometry & MOs

Info

ID:	405052
PubChem CID:	135072365
Reduced:	ClNOH22C29 (1)
Stoich.:	ABCD22E29 (1)
Weight, g/mol:	298.136908
ΔH_f, kcal/mol:	75.53
Dipole, Da:	3.36
IP(EA), eV:	-8.7(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-fluoro-3-[(E)-3-[(E)-3-(4-methoxyphenyl)prop-2-enoxy]prop-1-enyl]benzene

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)/C=C/C2=C(C=CC(=C2)Cl)N/C(=C\C(=O)C3=CC=CC=C3)/C4=CC=CC=C4

DOS

IR

Vibrations