Geometry & MOs

Info

ID:	17436
PubChem CID:	498588
Reduced:	HgSO2N6H8C11 (1)
Stoich.:	ABC2D6E8F11 (1)
Weight, g/mol:	490.013588
ΔH_f, kcal/mol:	165.07
Dipole, Da:	3.14
IP(EA), eV:	-8.98(-2.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-aminopurin-7-ide-6-thiol;(4-nitrophenyl)mercury(1+)

Drug info:

PubChemData

Smile

C1=CC(=CC=C1[N+](=O)[O-])[Hg+].C1=NC2=C([N-]1)C(=NC(=N2)N)S

DOS

IR

Vibrations