Geometry & MOs

Info

ID:	184328
PubChem CID:	77145772
Reduced:	O4C25H32 (1)
Stoich.:	A4B25C32 (1)
Weight, g/mol:	340.127051
ΔH_f, kcal/mol:	-144.65
Dipole, Da:	5.74
IP(EA), eV:	-8.93(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-propyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]furo[2,3-d]pyrimidin-2-one

Drug info:

PubChemData

Smile

CCCCCCCCCCOC1=CC=CC(=C1C(=O)C=CC2=CC=CC=C2O)O

DOS

IR

Vibrations