Geometry & MOs

Info

ID:	438382
PubChem CID:	135228118
Reduced:	NPO4C5H7 (2)
Stoich.:	ABC4D5E7 (2)
Weight, g/mol:	366.038189
ΔH_f, kcal/mol:	-397.42
Dipole, Da:	2.43
IP(EA), eV:	-8.63(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(5-ethoxybenzimidazol-1-yl)-1-hydroxy-1-phosphonoethyl]phosphonic acid

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)N(C=N2)CC(O)(P(=O)(O)O)P(=O)(O)O

DOS

IR

Vibrations