Geometry & MOs

Info

ID:	36118
PubChem CID:	7980785
Reduced:	NO5H19C22 (1)
Stoich.:	AB5C19D22 (1)
Weight, g/mol:	388.142307
ΔH_f, kcal/mol:	-132.81
Dipole, Da:	4.22
IP(EA), eV:	-8.72(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl] naphthalene-2-carboxylate

Drug info:

PubChemData

Smile

C[C@H](C1=CC2=C(C=C1)OCO2)NC(=O)COC(=O)C3=CC4=CC=CC=C4C=C3

DOS

IR

Vibrations