Geometry & MOs

Info

ID:	170788
PubChem CID:	75280050
Reduced:	ClN2O3C23H31 (1)
Stoich.:	AB2C3D23E31 (1)
Weight, g/mol:	272.152478
ΔH_f, kcal/mol:	-153.79
Dipole, Da:	6.01
IP(EA), eV:	-9.46(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-ethyl-2-oxo-4aH-quinolin-7-yl)-2,2-dimethylpropanamide

Drug info:

PubChemData

Smile

COCC1CC(=O)NC2C1CCC(C2)NC(=O)C3(CCCC3)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations