Geometry & MOs

Info

ID:	240955
PubChem CID:	93618403
Reduced:	FSN2O3C15H17 (1)
Stoich.:	ABC2D3E15F17 (1)
Weight, g/mol:	255.02588
ΔH_f, kcal/mol:	-129.72
Dipole, Da:	8.14
IP(EA), eV:	-10.14(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-1-(4-bromophenyl)propan-2-yl]acetamide

Drug info:

PubChemData

Smile

CCN(CC1=C(C=C(C=C1)C#N)F)C(=O)[C@@H]2CCS(=O)(=O)C2

DOS

IR

Vibrations