Geometry & MOs

Info

ID:	359374
PubChem CID:	127298509
Reduced:	SO2N4C20H32 (1)
Stoich.:	AB2C4D20E32 (1)
Weight, g/mol:	374.177647
ΔH_f, kcal/mol:	-105.6
Dipole, Da:	2.84
IP(EA), eV:	-8.71(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl]piperidin-4-yl]-2-cyclopentylacetamide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)NC(=O)C(C)N2CCC(CC2)NC(=O)CC3CCCC3)C

DOS

IR

Vibrations