Geometry & MOs

Info

ID:	347270
PubChem CID:	127272064
Reduced:	SN3O3C17H25 (1)
Stoich.:	AB3C3D17E25 (1)
Weight, g/mol:	372.161997
ΔH_f, kcal/mol:	-122.02
Dipole, Da:	4.37
IP(EA), eV:	-8.57(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1CCOC(C1)CNC(=O)CNC(=O)C2=CC3=C(S2)CCCC3

DOS

IR

Vibrations