Geometry & MOs

Info

ID:	135953
PubChem CID:	51958953
Reduced:	N2S2O3H20C21 (1)
Stoich.:	A2B2C3D20E21 (1)
Weight, g/mol:	340.158706
ΔH_f, kcal/mol:	-47.78
Dipole, Da:	4.42
IP(EA), eV:	-9.43(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-fluorophenyl)-N-[2-oxo-2-[[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl]acetamide

Drug info:

PubChemData

Smile

C1C[C@H](C2=CC=CC=C2C1)NC(=O)C3=CC(=CC=C3)NS(=O)(=O)C4=CC=CS4

DOS

IR

Vibrations