Geometry & MOs

Info

ID:	187076
PubChem CID:	77529123
Reduced:	N2O5C22H24 (1)
Stoich.:	A2B5C22D24 (1)
Weight, g/mol:	447.104205
ΔH_f, kcal/mol:	-154.75
Dipole, Da:	7.65
IP(EA), eV:	-8.49(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

prop-2-enyl 4-(4-cyano-2-methoxyphenyl)-2-hydroxy-5-oxo-2-(trifluoromethyl)-1,3-dihydro-1,6-naphthyridine-3-carboxylate

Drug info:

PubChemData

Smile

CN1CCOC2=C1C=C(C(=C2)C3(C4=CC=CC=C4N(C3=O)CC5CCCO5)O)O

DOS

IR

Vibrations