Geometry & MOs

Info

ID:	392226
PubChem CID:	135013797
Reduced:	NO3C18H21 (1)
Stoich.:	AB3C18D21 (1)
Weight, g/mol:	406.217551
ΔH_f, kcal/mol:	-94.82
Dipole, Da:	6.53
IP(EA), eV:	-9.45(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-[3-[(4-methoxyphenyl)methoxy]propyl]-2H-furan-5-one

Drug info:

PubChemData

Smile

C1CC=C([C@]2(C1)CCC(=O)N2[C@@H](CO)C3=CC=CC=C3)C=O

DOS

IR

Vibrations