Geometry & MOs

Info

ID:	347269
PubChem CID:	127272063
Reduced:	SN3O4C18H25 (1)
Stoich.:	AB3C4D18E25 (1)
Weight, g/mol:	351.161663
ΔH_f, kcal/mol:	-166.96
Dipole, Da:	6.2
IP(EA), eV:	-9.26(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(4-methylmorpholin-2-yl)methylamino]-2-oxoethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)N1CCOCC1)NC(=O)CNC(=O)C2=CC3=C(S2)CCCC3

DOS

IR

Vibrations