Geometry & MOs

Info

ID:	8277
PubChem CID:	75929
Reduced:	N5C9H13 (1)
Stoich.:	A5B9C13 (1)
Weight, g/mol:	191.117095
ΔH_f, kcal/mol:	49.09
Dipole, Da:	2.7
IP(EA), eV:	-8.92(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-butylpurin-6-amine

Drug info:

PubChemData

Smile

CCCCN1C=NC2=C(N=CN=C21)N

DOS

IR

Vibrations