Geometry & MOs

Info

ID:	170456
PubChem CID:	75236519
Reduced:	N2O5C32H40 (1)
Stoich.:	A2B5C32D40 (1)
Weight, g/mol:	277.959386
ΔH_f, kcal/mol:	-189.65
Dipole, Da:	4.78
IP(EA), eV:	-9.12(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

potassium;[2-(1,2-dihydroxyethyl)-5-oxo-2H-furan-4-yl] hydrogen phosphate

Drug info:

PubChemData

Smile

CC(CN1C=CC(=CC1=O)C2=CC=C(C=C2)C(C)N3CCC(OC3=O)(CC(C)(C)O)C4=CC=CC=C4)COC

DOS

IR

Vibrations