Geometry & MOs

Info

ID:	52386
PubChem CID:	12015232
Reduced:	ClNO8C23H26 (1)
Stoich.:	ABC8D23E26 (1)
Weight, g/mol:	367.141973
ΔH_f, kcal/mol:	-328.81
Dipole, Da:	2.73
IP(EA), eV:	-9.27(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-acetyl-2,6-dimethyl-4-(4-oxochromen-3-yl)-1,4-dihydropyridine-3-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C(C(C1=COC2=C(C1=O)C=C(C=C2)Cl)/C(=C(/C)\N)/C(=O)OCC)C(=O)OCC

DOS

IR

Vibrations