Geometry & MOs

Info

ID:	216132
PubChem CID:	85085769
Reduced:	NO5C10H17 (1)
Stoich.:	AB5C10D17 (1)
Weight, g/mol:	231.089543
ΔH_f, kcal/mol:	-210.53
Dipole, Da:	2.81
IP(EA), eV:	-10.41(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-ethyl-4-oxo-6H-quinoline-6-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1C(C1C(=O)OC)CO

DOS

IR

Vibrations