Geometry & MOs

Info

ID:	14048
PubChem CID:	402502
Reduced:	ClNO3H14C21 (1)
Stoich.:	ABC3D14E21 (1)
Weight, g/mol:	363.066221
ΔH_f, kcal/mol:	-53.34
Dipole, Da:	3.67
IP(EA), eV:	-8.55(-1.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(chloromethyl)-N-naphthalen-2-yl-2-oxochromene-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C2C=C(C=CC2=C1)NC(=O)C3=CC4=C(C=CC(=C4)CCl)OC3=O

DOS

IR

Vibrations