Geometry & MOs

Info

ID:	358693
PubChem CID:	127296483
Reduced:	SN2O3C20H36 (1)
Stoich.:	AB2C3D20E36 (1)
Weight, g/mol:	345.187484
ΔH_f, kcal/mol:	-169.97
Dipole, Da:	4.61
IP(EA), eV:	-8.67(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-[cyclopentyl(propan-2-yl)amino]propanamide

Drug info:

PubChemData

Smile

CC(C)N(CC(=O)N(C1CCCCC1)C2CCS(=O)(=O)C2)C3CCCC3

DOS

IR

Vibrations