Geometry & MOs

Info

ID:	391440
PubChem CID:	135005095
Reduced:	Si2O3C27H32 (1)
Stoich.:	A2B3C27D32 (1)
Weight, g/mol:	411.0599
ΔH_f, kcal/mol:	-114.54
Dipole, Da:	6.45
IP(EA), eV:	-8.52(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-5-(1,3-benzodioxol-5-yl)-2-(1,3-dithiolan-2-ylidene)-3-oxo-N-phenylpent-4-enamide

Drug info:

PubChemData

Smile

C[Si](C)(C)C#CCC1(CC(=C2C(=C(C(=O)O2)[Si](C)(C)C)C1)C3=CC4=CC=CC=C4C=C3)O

DOS

IR

Vibrations