Geometry & MOs

Info

ID:	347271
PubChem CID:	127272065
Reduced:	SO2N4C19H24 (1)
Stoich.:	AB2C4D19E24 (1)
Weight, g/mol:	372.161997
ΔH_f, kcal/mol:	-53.3
Dipole, Da:	5.01
IP(EA), eV:	-9.18(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[2-(1H-imidazol-2-yl)piperidin-1-yl]-2-oxoethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C=C(S2)C(=O)NCC(=O)N3CCC(CC3)C4=NC=CN4

DOS

IR

Vibrations