Geometry & MOs

Info

ID:	273060
PubChem CID:	103770415
Reduced:	BrNF2O3C11H12 (1)
Stoich.:	ABC2D3E11F12 (1)
Weight, g/mol:	328.985562
ΔH_f, kcal/mol:	-204.22
Dipole, Da:	4.78
IP(EA), eV:	-9.69(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,5-dichlorophenyl)sulfanyl-N-(3,3-difluoro-2-hydroxypropyl)acetamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)Br)OCC(=O)NCC(C(F)F)O

DOS

IR

Vibrations