Geometry & MOs

Info

ID:	381585
PubChem CID:	134972367
Reduced:	SiO5C27H40 (1)
Stoich.:	AB5C27D40 (1)
Weight, g/mol:	355.087829
ΔH_f, kcal/mol:	-223.31
Dipole, Da:	2.44
IP(EA), eV:	-8.96(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-benzylsulfanyl-2-(1,3-dioxoisoindol-2-yl)propanoate

Drug info:

PubChemData

Smile

C[C@@H](CCO[Si](C1=CC=CC=C1)(C2=CC=CC=C2)C(C)(C)C)[C@@H](C[C@H]3[C@@H](O3)CO)OCOC

DOS

IR

Vibrations