Geometry & MOs

Info

ID:	36009
PubChem CID:	7980634
Reduced:	NO4C26H27 (1)
Stoich.:	AB4C26D27 (1)
Weight, g/mol:	389.199094
ΔH_f, kcal/mol:	-110.05
Dipole, Da:	5.36
IP(EA), eV:	-8.21(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[2,6-di(propan-2-yl)anilino]-2-oxoethyl] naphthalene-2-carboxylate

Drug info:

PubChemData

Smile

CCCOC1=CC=C(C=C1)C(=O)CCC(=O)NC2=CC=C(C=C2)OC3=CC=C(C=C3)C

DOS

IR

Vibrations