Geometry & MOs

Info

ID:	179860
PubChem CID:	76545105
Reduced:	O2C7H12 (4)
Stoich.:	A2B7C12 (4)
Weight, g/mol:	377.033425
ΔH_f, kcal/mol:	-436.92
Dipole, Da:	2.92
IP(EA), eV:	-10.73(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3,4-dihydroxy-5-(4-methoxy-1,3-benzothiazol-2-yl)oxolan-2-yl]methyl dihydrogen phosphate

Drug info:

PubChemData

Smile

C(CCCCCCCC(=O)O)CCCCCCC=C(C(CCCCCCC(=O)O)CC(=O)O)C(=O)O

DOS

IR

Vibrations