Geometry & MOs

Info

ID:	190659
PubChem CID:	78036491
Reduced:	SiO7C26H54 (1)
Stoich.:	AB7C26D54 (1)
Weight, g/mol:	309.103479
ΔH_f, kcal/mol:	-444.03
Dipole, Da:	2.27
IP(EA), eV:	-8.67(1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(1-propanoylpyrrolidin-2-yl)methylsulfinyl]benzoic acid

Drug info:

PubChemData

Smile

CCCCOC1CC(C(OC(C1OCCCC)CO[Si](C)(C)C(C)(C)C)O)OC(CC)(CC)O

DOS

IR

Vibrations