Geometry & MOs

Info

ID:	1475
PubChem CID:	4564
Reduced:	ON5C12H17 (1)
Stoich.:	AB5C12D17 (1)
Weight, g/mol:	247.14331
ΔH_f, kcal/mol:	8.58
Dipole, Da:	6.21
IP(EA), eV:	-8.73(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(cyclohexylmethoxy)-7H-purin-2-amine

Drug info:

PubChemData

Smile

C1CCC(CC1)COC2=NC(=NC3=C2NC=N3)N

DOS

IR

Vibrations