Geometry & MOs

Info

ID:	7036
PubChem CID:	71029
Reduced:	N5H9C11 (1)
Stoich.:	A5B9C11 (1)
Weight, g/mol:	211.085795
ΔH_f, kcal/mol:	103.66
Dipole, Da:	7.43
IP(EA), eV:	-9.13(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-phenyl-7H-purin-6-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NC2=NC=NC3=C2NC=N3

DOS

IR

Vibrations