Geometry & MOs

Info

ID:	199191
PubChem CID:	79212778
Reduced:	NSO4C13H15 (1)
Stoich.:	ABC4D13E15 (1)
Weight, g/mol:	290.145285
ΔH_f, kcal/mol:	-160.27
Dipole, Da:	6.21
IP(EA), eV:	-8.99(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(aminomethyl)cyclopentyl]-N-methyl-2,3-dihydro-1-benzothiophene-3-carboxamide

Drug info:

PubChemData

Smile

CC(CNC(=O)C1CSC2=CC=CC=C12)(C(=O)O)O

DOS

IR

Vibrations