Geometry & MOs

Info

ID:	154590
PubChem CID:	56314056
Reduced:	FSN2O4C23H29 (1)
Stoich.:	ABC2D4E23F29 (1)
Weight, g/mol:	435.162806
ΔH_f, kcal/mol:	-184.3
Dipole, Da:	3.98
IP(EA), eV:	-9.31(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-acetamidophenyl)sulfonyl-methylamino]-N-[2-(2-fluorophenyl)-2-methylpropyl]acetamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)OC)C3=CC=CC=C3F

DOS

IR

Vibrations