Geometry & MOs

Info

ID:	36003
PubChem CID:	7980628
Reduced:	NO2C19H19 (1)
Stoich.:	AB2C19D19 (1)
Weight, g/mol:	376.088164
ΔH_f, kcal/mol:	-15.99
Dipole, Da:	5.67
IP(EA), eV:	-8.35(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-2-oxoethyl] naphthalene-2-carboxylate

Drug info:

PubChemData

Smile

C/C=C/C=C/C(=O)NC1=CC=C(C=C1)OC2=CC=C(C=C2)C

DOS

IR

Vibrations