Geometry & MOs

Info

ID:	8281
PubChem CID:	75969
Reduced:	O4H7C9 (2)
Stoich.:	A4B7C9 (2)
Weight, g/mol:	358.068867
ΔH_f, kcal/mol:	-271.38
Dipole, Da:	11.53
IP(EA), eV:	-10.61(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3R)-2,3-dibenzoyloxybutanedioic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)O[C@H]([C@H](C(=O)O)OC(=O)C2=CC=CC=C2)C(=O)O

DOS

IR

Vibrations