Geometry & MOs

Info

ID:	15277
PubChem CID:	435677
Reduced:	O2N5C18H23 (1)
Stoich.:	A2B5C18D23 (1)
Weight, g/mol:	341.185175
ΔH_f, kcal/mol:	-43.48
Dipole, Da:	4.91
IP(EA), eV:	-8.75(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[3-(dimethylamino)propylamino]-1,3-dimethylpyrimido[4,5-b]quinoline-2,4-dione

Drug info:

PubChemData

Smile

CN1C2=NC3=CC=CC=C3C(=C2C(=O)N(C1=O)C)NCCCN(C)C

DOS

IR

Vibrations