Geometry & MOs

Info

ID:	77622
PubChem CID:	49658436
Reduced:	ClN2O5H17C20 (1)
Stoich.:	AB2C5D17E20 (1)
Weight, g/mol:	379.129884
ΔH_f, kcal/mol:	-154.49
Dipole, Da:	5.19
IP(EA), eV:	-9.19(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 7-chloro-4-(2-morpholin-4-ylethylamino)-2-oxo-1H-quinoline-3-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C2=C(C=C(C=C2)Cl)NC1=O)NCC3=CC4=C(C=C3)OCO4

DOS

IR

Vibrations