Geometry & MOs

Info

ID:	44990
PubChem CID:	10507046
Reduced:	SiN2O8C27H50 (1)
Stoich.:	AB2C8D27E50 (1)
Weight, g/mol:	558.102764
ΔH_f, kcal/mol:	-421.2
Dipole, Da:	1.88
IP(EA), eV:	-8.77(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-(1-carbamoyl-6-chloro-5-fluoro-2-oxoindol-3-ylidene)-thiophen-2-ylmethoxy]methyl 2-phenylmethoxypentanoate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1C[C@@H](C[C@H]1[C@H](COC2CCCCO2)CONC(=O)OCC=C)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations