Geometry & MOs

Info

ID:	34111
PubChem CID:	7889861
Reduced:	ClNO5H14C16 (1)
Stoich.:	ABC5D14E16 (1)
Weight, g/mol:	402.194343
ΔH_f, kcal/mol:	-88.94
Dipole, Da:	5.01
IP(EA), eV:	-9.75(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-(4-ethylanilino)-1-oxopropan-2-yl] 1,2,3,4-tetrahydroacridine-9-carboxylate

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=CC=C1Cl)OC(=O)COC2=CC=CC=C2[N+](=O)[O-]

DOS

IR

Vibrations