Geometry & MOs

Info

ID:	77189
PubChem CID:	48425903
Reduced:	BrN3O3C17H22 (1)
Stoich.:	AB3C3D17E22 (1)
Weight, g/mol:	409.128312
ΔH_f, kcal/mol:	-119.28
Dipole, Da:	8.98
IP(EA), eV:	-8.8(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)-2-oxoethyl]-2-[[2-(trifluoromethyl)phenyl]sulfonylamino]propanamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)C1CC(=O)N(C1)C2=CC=C(C=C2)Br

DOS

IR

Vibrations