Geometry & MOs

Info

ID:	2003
PubChem CID:	5546
Reduced:	N7H11C12 (1)
Stoich.:	A7B11C12 (1)
Weight, g/mol:	253.107593
ΔH_f, kcal/mol:	100.74
Dipole, Da:	2.99
IP(EA), eV:	-8.76(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-phenylpteridine-2,4,7-triamine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NC3=C(N=C(N=C3N=C2N)N)N

DOS

IR

Vibrations