Geometry & MOs

Info

ID:	85397
PubChem CID:	49874737
Reduced:	O4H9C10 (2)
Stoich.:	A4B9C10 (2)
Weight, g/mol:	618.267627
ΔH_f, kcal/mol:	-288.97
Dipole, Da:	5.94
IP(EA), eV:	-9.76(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ditert-butyl (2R,3R)-2,3-bis[[2-(3,4-dimethoxyphenyl)acetyl]oxy]butanedioate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC(=O)O[C@H]([C@H](C(=O)O)OC(=O)CC2=CC=CC=C2)C(=O)O

DOS

IR

Vibrations