Geometry & MOs

Info

ID:	397255
PubChem CID:	135029961
Reduced:	SSiN2O6C31H52 (1)
Stoich.:	ABC2D6E31F52 (1)
Weight, g/mol:	424.300886
ΔH_f, kcal/mol:	-308.33
Dipole, Da:	4.28
IP(EA), eV:	-8.81(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2S,5R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-undec-2-enyl-2H-furan-5-carboxylate

Drug info:

PubChemData

Smile

CCCCCCCCC=CC[C@@]1(/C(=N/NS(=O)(=O)C2=CC=C(C=C2)C)/C[C@H](O1)CO[Si](C)(C)C(C)(C)C)C(=O)OC

DOS

IR

Vibrations