Geometry & MOs

Info

ID:	139101
PubChem CID:	52472343
Reduced:	NOC8H13 (2)
Stoich.:	ABC8D13 (2)
Weight, g/mol:	419.175953
ΔH_f, kcal/mol:	-102.53
Dipole, Da:	1.98
IP(EA), eV:	-8.17(0.22)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

(4E)-2-benzyl-4-[(3-methylphenyl)methylidene]-1,3-dihydrobenzo[b][1,6]naphthyridine-10-carboxylate

Drug info:

PubChemData

Smile

CCCCCCNC(=O)NC1=CC=C(C=C1)OC(C)C

DOS

IR

Vibrations