Geometry & MOs

Info

ID:	388823
PubChem CID:	134990318
Reduced:	ON2H14C15 (1)
Stoich.:	AB2C14D15 (1)
Weight, g/mol:	294.977577
ΔH_f, kcal/mol:	54.91
Dipole, Da:	2.35
IP(EA), eV:	-8.38(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-aminopropyl)-2,4,6-trihydroxy-4,6-dioxo-1,3,2,4lambda5,6lambda5-dioxatriphosphinan-5-ol

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C/C(=N/O)/C3=CC=CC=C31

DOS

IR

Vibrations