Geometry & MOs

Info

ID:	358339
PubChem CID:	127295884
Reduced:	N2O5C17H22 (1)
Stoich.:	A2B5C17D22 (1)
Weight, g/mol:	350.166414
ΔH_f, kcal/mol:	-179.76
Dipole, Da:	1.13
IP(EA), eV:	-9.2(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[methyl(oxan-3-ylmethyl)amino]-2-oxoethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Drug info:

PubChemData

Smile

CN(CC1CCCOC1)C(=O)CNC(=O)C2=CC3=C(C=C2)OCO3

DOS

IR

Vibrations