Geometry & MOs

Info

ID:	35203
PubChem CID:	7979480
Reduced:	FSN2O4H19C21 (1)
Stoich.:	ABC2D4E19F21 (1)
Weight, g/mol:	415.156577
ΔH_f, kcal/mol:	-164.29
Dipole, Da:	6.47
IP(EA), eV:	-9.0(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-1-[2-(4-ethoxybenzoyl)hydrazinyl]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide

Drug info:

PubChemData

Smile

C1C[C@]2(N(C1=O)[C@@H](CS2)C(=O)OCC(=O)NC3=CC=C(C=C3)F)C4=CC=CC=C4

DOS

IR

Vibrations