Geometry & MOs

Info

ID:	446524
PubChem CID:	135275658
Reduced:	O4N5C26H37 (1)
Stoich.:	A4B5C26D37 (1)
Weight, g/mol:	318.157957
ΔH_f, kcal/mol:	-153.56
Dipole, Da:	4.0
IP(EA), eV:	-8.38(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-[(E)-3-methoxy-3-oxoprop-1-enyl]-6,8-dihydro-5H-1,7-naphthyridine-7-carboxylate

Drug info:

PubChemData

Smile

CCN(C1=C(C(=C(C=C1)C(CC(=O)OC)C2=NC3=C(CCN(C3)C(=O)OC(C)(C)C)C=C2)C)N)N

DOS

IR

Vibrations