Geometry & MOs

Info

ID:	446075
PubChem CID:	135272173
Reduced:	O2N3C20H29 (1)
Stoich.:	A2B3C20D29 (1)
Weight, g/mol:	314.210661
ΔH_f, kcal/mol:	-77.25
Dipole, Da:	7.54
IP(EA), eV:	-8.53(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(dimethylamino)propylamino]-N,6,8-trimethylquinoline-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C2C(=C1)C(=C(C=N2)C(=O)OC(C)C)NCCCN(C)C)C

DOS

IR

Vibrations