Geometry & MOs

Info

ID:	391960
PubChem CID:	135011399
Reduced:	O7C23H26 (1)
Stoich.:	A7B23C26 (1)
Weight, g/mol:	689.07659
ΔH_f, kcal/mol:	-268.52
Dipole, Da:	4.32
IP(EA), eV:	-9.45(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(2E)-1-diethoxyphosphoryl-2-[4-ethylidene-1-(4-methylphenyl)sulfonylpyrrolidin-3-ylidene]-1-phenylpropan-1-ol;phosphane;rhodium(2+)

Drug info:

PubChemData

Smile

CCOC(=O)C(=C(C)C1=C(CC(C1)(C(=O)OC)C(=O)OC)C(=O)C)C2=CC=CC=C2

DOS

IR

Vibrations