Geometry & MOs

Info

ID:	63657
PubChem CID:	26758890
Reduced:	ClNO4H20C22 (1)
Stoich.:	ABC4D20E22 (1)
Weight, g/mol:	377.162708
ΔH_f, kcal/mol:	-116.37
Dipole, Da:	5.64
IP(EA), eV:	-9.04(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(2,5-dimethylanilino)-1-oxopropan-2-yl] 3-methoxynaphthalene-2-carboxylate

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NCC1=CC=C(C=C1)Cl)OC(=O)C2=CC3=CC=CC=C3C=C2OC

DOS

IR

Vibrations