Geometry & MOs

Info

ID:	391800
PubChem CID:	135009706
Reduced:	NSiO2C25H31 (1)
Stoich.:	ABC2D25E31 (1)
Weight, g/mol:	351.163457
ΔH_f, kcal/mol:	-28.69
Dipole, Da:	2.94
IP(EA), eV:	-8.71(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C[C@@H]1C(=C([C@@H](ON1C(=O)/C=C/C2=CC=CC=C2)C3=CC=CC=C3)C)C[Si](C)(C)C

DOS

IR

Vibrations