Geometry & MOs

Info

ID:	439181
PubChem CID:	135228946
Reduced:	NC11H14 (2)
Stoich.:	AB11C14 (2)
Weight, g/mol:	321.210407
ΔH_f, kcal/mol:	39.16
Dipole, Da:	4.19
IP(EA), eV:	-8.01(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(1R,4E,5E)-5-fluoro-1-hydroxy-4-[(E)-4-(methylideneamino)but-3-en-2-ylidene]octa-5,7-dienyl]cyclohexan-1-ol

Drug info:

PubChemData

Smile

CC=N/C=C(\C)/C1=CC=CC=C1C(C)CC(C)C2=CC=CC=C2N

DOS

IR

Vibrations