Geometry & MOs

Info

ID:	65210
PubChem CID:	29204617
Reduced:	FN3O3C20H20 (1)
Stoich.:	AB3C3D20E20 (1)
Weight, g/mol:	471.042247
ΔH_f, kcal/mol:	-40.04
Dipole, Da:	9.23
IP(EA), eV:	-9.3(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[(2S)-1-[2-(4-chlorobenzoyl)hydrazinyl]-4-methylsulfonyl-1-oxobutan-2-yl]benzamide

Drug info:

PubChemData

Smile

CC[C@@H](C(=O)NC1=NON=C1C2=CC(=C(C=C2)C)C)OC3=CC=CC=C3F

DOS

IR

Vibrations