Geometry & MOs

Info

ID:	43059
PubChem CID:	10318253
Reduced:	SiO7C18H34 (1)
Stoich.:	AB7C18D34 (1)
Weight, g/mol:	390.267114
ΔH_f, kcal/mol:	-364.51
Dipole, Da:	4.83
IP(EA), eV:	-8.83(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-[4-(5-heptylpyridin-2-yl)phenyl]-1-piperidin-1-ylprop-2-en-1-one

Drug info:

PubChemData

Smile

CC(=O)O[C@H]1[C@@H]([C@H](C=C1CO[Si](C)(C)C(C)(C)C)OCOC)OCOC

DOS

IR

Vibrations