Geometry & MOs

Info

ID:	382530
PubChem CID:	134973751
Reduced:	PSiO4C17H35 (1)
Stoich.:	ABC4D17E35 (1)
Weight, g/mol:	559.220617
ΔH_f, kcal/mol:	-304.9
Dipole, Da:	3.05
IP(EA), eV:	-8.8(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,4-dimethoxyphenyl)-5-ethoxycarbonyl-4-(4-methoxyphenyl)-1-[2-(4-methoxyphenyl)ethyl]pyrrole-2-carboxylic acid

Drug info:

PubChemData

Smile

CCOP(=O)(C/C=C/C(=CC)CO[Si](C)(C)C(C)(C)C)OCC

DOS

IR

Vibrations