Geometry & MOs

Info

ID:	395523
PubChem CID:	135025705
Reduced:	N3O6H17C21 (1)
Stoich.:	A3B6C17D21 (1)
Weight, g/mol:	295.120843
ΔH_f, kcal/mol:	-161.56
Dipole, Da:	6.73
IP(EA), eV:	-8.93(-2.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-5-methoxy-4-oxo-2,3-dihydro-1H-naphthalen-2-yl]benzamide

Drug info:

PubChemData

Smile

COC1CCN(C2=C1C(=C3C4=C(C5=CC=CC=C5N=C42)C(=O)N3)C(=O)O)C(=O)OC

DOS

IR

Vibrations