Geometry & MOs

Info

ID:	391809
PubChem CID:	135009747
Reduced:	Si2O4C41H54 (1)
Stoich.:	A2B4C41D54 (1)
Weight, g/mol:	337.147807
ΔH_f, kcal/mol:	-120.5
Dipole, Da:	1.52
IP(EA), eV:	-8.73(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-1-[(5R,6S)-5-fluoro-5-methyl-4-methylidene-6-phenyloxazinan-2-yl]-3-phenylprop-2-en-1-one

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C1=CC=CC=C1)(C2=CC=CC=C2)O[C@@H](CCCC=C)C#C[C@@H]([C@H](CCC#C[Si](C)(C)C)OCC3=CC=C(C=C3)OC)O

DOS

IR

Vibrations