Geometry & MOs

Info

ID:	318029
PubChem CID:	126648434
Reduced:	ClN3O3C8H10 (1)
Stoich.:	AB3C3D8E10 (1)
Weight, g/mol:	370.189257
ΔH_f, kcal/mol:	-145.4
Dipole, Da:	2.63
IP(EA), eV:	-9.78(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methylphenyl)ethyl 1-butyl-5-(methylcarbamoyl)-6-oxopyridine-3-carboxylate

Drug info:

PubChemData

Smile

CN1C=C(C=C(C1=O)C(=O)N)C(=O)N.Cl

DOS

IR

Vibrations