Geometry & MOs

Info

ID:	36110
PubChem CID:	7980775
Reduced:	N2O4C19H20 (1)
Stoich.:	A2B4C19D20 (1)
Weight, g/mol:	378.121572
ΔH_f, kcal/mol:	-136.09
Dipole, Da:	2.88
IP(EA), eV:	-9.12(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4,5-dimethyl-2-nitroanilino)-2-oxoethyl] naphthalene-2-carboxylate

Drug info:

PubChemData

Smile

C1CN(CCC1C(=O)N)C(=O)COC(=O)C2=CC3=CC=CC=C3C=C2

DOS

IR

Vibrations