Geometry & MOs

Info

ID:	155781
PubChem CID:	56367532
Reduced:	S2N3O6C22H29 (1)
Stoich.:	A2B3C6D22E29 (1)
Weight, g/mol:	351.161663
ΔH_f, kcal/mol:	-203.44
Dipole, Da:	5.16
IP(EA), eV:	-9.41(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[3-(butanoylamino)piperidin-1-yl]-2-oxoethyl]-N-methylthiophene-2-carboxamide

Drug info:

PubChemData

Smile

CN(C)S(=O)(=O)C1=C(C=CC(=C1)C(=O)NCC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)OC

DOS

IR

Vibrations