Geometry & MOs

Info

ID:	34369
PubChem CID:	7890973
Reduced:	NO4H19C21 (1)
Stoich.:	AB4C19D21 (1)
Weight, g/mol:	404.033062
ΔH_f, kcal/mol:	-119.56
Dipole, Da:	3.66
IP(EA), eV:	-9.05(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-[(3,5-dichloropyridin-2-yl)amino]-1-oxopropan-2-yl] 1-hydroxynaphthalene-2-carboxylate

Drug info:

PubChemData

Smile

C[C@H](C(=O)NCC1=CC=CC=C1)OC(=O)C2=C(C3=CC=CC=C3C=C2)O

DOS

IR

Vibrations