Geometry & MOs

Info

ID:	63687
PubChem CID:	26758975
Reduced:	NSO6C21H25 (1)
Stoich.:	ABC6D21E25 (1)
Weight, g/mol:	406.152872
ΔH_f, kcal/mol:	-223.0
Dipole, Da:	6.48
IP(EA), eV:	-8.89(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(benzylcarbamoylamino)-1-oxopropan-2-yl] 3-methoxynaphthalene-2-carboxylate

Drug info:

PubChemData

Smile

CCN([C@H]1CCS(=O)(=O)C1)C(=O)[C@H](C)OC(=O)C2=CC3=CC=CC=C3C=C2OC

DOS

IR

Vibrations