Geometry & MOs

Info

ID:	14491
PubChem CID:	413263
Reduced:	OCl2N5H7C10 (1)
Stoich.:	AB2C5D7E10 (1)
Weight, g/mol:	283.002765
ΔH_f, kcal/mol:	89.8
Dipole, Da:	6.96
IP(EA), eV:	-9.98(-1.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,8-dichloro-N-(furan-2-ylmethyl)-5H-purin-6-amine

Drug info:

PubChemData

Smile

C1=COC(=C1)CNC2=NC(=NC3=NC(=NC32)Cl)Cl

DOS

IR

Vibrations