Geometry & MOs

Info

ID:	131983
PubChem CID:	51286411
Reduced:	FN3O3C16H20 (1)
Stoich.:	AB3C3D16E20 (1)
Weight, g/mol:	388.072691
ΔH_f, kcal/mol:	-79.81
Dipole, Da:	5.02
IP(EA), eV:	-9.08(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(difluoromethylsulfonyl)phenyl]-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide

Drug info:

PubChemData

Smile

C1CCN(C1)C(=O)C2CCN(CC2)C3=C(C=C(C=C3)F)[N+](=O)[O-]

DOS

IR

Vibrations