Geometry & MOs

Info

ID:	150486
PubChem CID:	53790178
Reduced:	ClN4C22H27 (1)
Stoich.:	AB4C22D27 (1)
Weight, g/mol:	146.059246
ΔH_f, kcal/mol:	64.81
Dipole, Da:	1.25
IP(EA), eV:	-8.86(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

pyrido[2,3-d]pyrimidin-5-amine

Drug info:

PubChemData

Smile

CCCCCCCNNC1=NC2=C(C=C(C=C2)Cl)C(=NC1)C3=CC=CC=C3

DOS

IR

Vibrations