Geometry & MOs

Info

ID:

375746

PubChem CID:

134221736

Reduced:

NP2O23C27H55 (1)

Stoich.:

AB2C23D27E55 (1)

Weight, g/mol:

791.274182

ΔHf, kcal/mol:

-1176.46

Dipole, Da:

1.15

IP(EA), eV:

 -9.4(-0.18)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[5-[4-[5-aminopentoxy(hydroxy)phosphanyl]oxy-5-(hydroxymethyl)-3-methoxyoxolan-2-yl]oxy-2,3,4-trihydroxypentyl] [2-(hydroxymethyl)-4-methoxy-5-(2,3,4,5-tetrahydroxypentoxy)oxolan-3-yl] hydrogen phosphite

Drug info:

PubChemData

Smile

COC1C(C(OC1OCC(C(C(COP(=O)(O)OC2C(OC(C2OC)OCC(C(C(CO)O)O)O)CO)O)O)O)CO)OP(=O)(O)OCCCCCN

DOS

IR

Vibrations