Geometry & MOs

Info

ID:	343438
PubChem CID:	127266611
Reduced:	FSN2O3C9H17 (1)
Stoich.:	ABC2D3E9F17 (1)
Weight, g/mol:	342.00153
ΔH_f, kcal/mol:	-175.16
Dipole, Da:	4.31
IP(EA), eV:	-9.99(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromo-3-nitrophenyl)-1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)ethanone

Drug info:

PubChemData

Smile

CCC=C(C(=O)NCCNS(=O)(=O)CC)F

DOS

IR

Vibrations