Geometry & MOs

Info

ID:	154952
PubChem CID:	56314509
Reduced:	OF3N4C22H29 (1)
Stoich.:	AB3C4D22E29 (1)
Weight, g/mol:	387.165034
ΔH_f, kcal/mol:	-166.26
Dipole, Da:	4.01
IP(EA), eV:	-8.86(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-butylpiperidin-2-yl)methyl]-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide

Drug info:

PubChemData

Smile

CCCCN1CCCCC1CNC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)C)C(F)(F)F

DOS

IR

Vibrations