Geometry & MOs

Info

ID:	35996
PubChem CID:	7980619
Reduced:	N2O2H16C19 (1)
Stoich.:	A2B2C16D19 (1)
Weight, g/mol:	339.092915
ΔH_f, kcal/mol:	2.42
Dipole, Da:	4.65
IP(EA), eV:	-8.48(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-[[(1R)-1-thiophen-2-ylethyl]amino]ethyl] naphthalene-2-carboxylate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)C3=CC=CC=N3

DOS

IR

Vibrations