Geometry & MOs

Info

ID:

50172

PubChem CID:

12012680

Reduced:

OSN3C12H13 (1)

Stoich.:

ABC3D12E13 (1)

Weight, g/mol:

1208.228068

ΔHf, kcal/mol:

7.86

Dipole, Da:

3.34

IP(EA), eV:

-8.62(-0.62)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

disodium;[25,27-dihydroxy-17-[[hydroxy(oxido)phosphoryl]methyl]-26,28-bis[[6-(6-methylpyridin-2-yl)pyridin-2-yl]methoxy]-11,23-bis(phosphonomethyl)-5-pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(24),3,5,7(28),9,11,13(27),15(26),16,18,21(25),22-dodecaenyl]methyl-hydroxyphosphinate

Drug info:

PubChemData

Smile

CC1C(=O)NN=C2N1C3=CC=CC=C3SC2C

DOS

IR

Vibrations