Geometry & MOs

Info

ID:	63658
PubChem CID:	26758893
Reduced:	NO4C23H23 (1)
Stoich.:	AB4C23D23 (1)
Weight, g/mol:	424.127051
ΔH_f, kcal/mol:	-124.06
Dipole, Da:	6.9
IP(EA), eV:	-8.54(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-(4-methoxy-2-nitroanilino)-1-oxopropan-2-yl] 3-methoxynaphthalene-2-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)NC(=O)[C@@H](C)OC(=O)C2=CC3=CC=CC=C3C=C2OC

DOS

IR

Vibrations