Geometry & MOs

Info

ID:	418781
PubChem CID:	135106792
Reduced:	N4O5C17H18 (1)
Stoich.:	A4B5C17D18 (1)
Weight, g/mol:	331.189592
ΔH_f, kcal/mol:	-129.11
Dipole, Da:	5.52
IP(EA), eV:	-8.72(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(6,7-dimethoxy-4-methylquinolin-2-yl)amino]ethyl]-2-methylpropanamide

Drug info:

PubChemData

Smile

C1C(CN2C(=CC(=N2)C(=O)NCC3COC4=CC=CC=C4O3)C(=O)N1)O

DOS

IR

Vibrations