Geometry & MOs

Info

ID:	393287
PubChem CID:	135019979
Reduced:	SiO3C25H34 (1)
Stoich.:	AB3C25D34 (1)
Weight, g/mol:	288.163791
ΔH_f, kcal/mol:	-147.33
Dipole, Da:	0.96
IP(EA), eV:	-9.05(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-2-hex-1-ynyl-6-piperidin-1-ylpyridine-3-carbaldehyde

Drug info:

PubChemData

Smile

CC1(O[C@H]([C@@H](O1)CO[Si](C2=CC=CC=C2)(C3=CC=CC=C3)C(C)(C)C)CC=C)C

DOS

IR

Vibrations