Geometry & MOs

Info

ID:	170421
PubChem CID:	75231446
Reduced:	O13C23H40 (1)
Stoich.:	A13B23C40 (1)
Weight, g/mol:	494.236327
ΔH_f, kcal/mol:	-583.43
Dipole, Da:	5.8
IP(EA), eV:	-9.95(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,2-dihydroxyethyl)-3-(2-hydroxydecoxy)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2H-furan-5-one

Drug info:

PubChemData

Smile

CCCCCCCCOCC(COC1=C(C(=O)OC1C(CO)O)OC2C(C(C(C(O2)CO)O)O)O)O

DOS

IR

Vibrations