Geometry & MOs

Info

ID:	392896
PubChem CID:	135018336
Reduced:	ClYH4C6 (1)
Stoich.:	ABC4D6 (1)
Weight, g/mol:	305.041287
ΔH_f, kcal/mol:	50.5
Dipole, Da:	0.92
IP(EA), eV:	-5.78(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,10R)-5-amino-13-hydroxy-13-oxo-8,12,14,16-tetraoxa-2,4-diaza-13lambda5-phosphatetracyclo[8.5.1.02,7.011,15]hexadec-4-en-3-one

Drug info:

PubChemData

Smile

C1=CC(=CC=[C-]1)Cl.[Y]

DOS

IR

Vibrations