Geometry & MOs

Info

ID:	51675
PubChem CID:	12014385
Reduced:	NO3H21C26 (1)
Stoich.:	AB3C21D26 (1)
Weight, g/mol:	217.073893
ΔH_f, kcal/mol:	-25.94
Dipole, Da:	4.33
IP(EA), eV:	-9.54(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1R)-2-hydroxy-1-phenylethyl]pyrrole-2,5-dione

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)[C@H](CO)N2C(=O)C3C(C2=O)C4C5=CC=CC=C5C3C6=CC=CC=C46

DOS

IR

Vibrations