Geometry & MOs

Info

ID:	383487
PubChem CID:	134975232
Reduced:	GeNF3O3C13H16 (1)
Stoich.:	ABC3D3E13F16 (1)
Weight, g/mol:	411.262088
ΔH_f, kcal/mol:	-288.08
Dipole, Da:	3.97
IP(EA), eV:	-8.61(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethoxycarbonyl-3,4-bis(hexoxymethyl)-1H-pyrrole-2-carboxylic acid

Drug info:

PubChemData

Smile

C1CO[Ge]2(OCCN1CCO2)C3=CC=C(C=C3)C(F)(F)F

DOS

IR

Vibrations