Geometry & MOs

Info

ID:	16723
PubChem CID:	476043
Reduced:	N3C7H7 (2)
Stoich.:	A3B7C7 (2)
Weight, g/mol:	266.127994
ΔH_f, kcal/mol:	94.63
Dipole, Da:	2.68
IP(EA), eV:	-8.0(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-N-methyl-6-N-phenylpyrido[3,2-d]pyrimidine-2,4,6-triamine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations