Geometry & MOs

Info

ID:	133705
PubChem CID:	51576620
Reduced:	SCl2N2O3C21H26 (1)
Stoich.:	AB2C2D3E21F26 (1)
Weight, g/mol:	431.184506
ΔH_f, kcal/mol:	-152.03
Dipole, Da:	5.37
IP(EA), eV:	-9.18(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-1-benzyl-N'-[(2S)-2-naphthalen-2-yloxypropanoyl]-5-oxopyrrolidine-3-carbohydrazide

Drug info:

PubChemData

Smile

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C34C[C@H]5C[C@@H](C3)CC(C5)(C4)Cl)Cl

DOS

IR

Vibrations