Geometry & MOs

Info

ID:	177408
PubChem CID:	76181945
Reduced:	NO6H7C8 (1)
Stoich.:	AB6C7D8 (1)
Weight, g/mol:	504.199547
ΔH_f, kcal/mol:	-219.39
Dipole, Da:	2.49
IP(EA), eV:	-10.64(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-O-[2-(1,2-dihydroxyethyl)-3-hydroxy-5-oxo-2H-furan-4-yl] 1-O-(2,5,7,8-tetramethyl-2-propan-2-yl-3,4-dihydrochromen-6-yl) but-2-enedioate

Drug info:

PubChemData

Smile

C1=C(C(C(=NC1=O)CC(=O)O)C(=O)O)O

DOS

IR

Vibrations