Geometry & MOs

Info

ID:	359395
PubChem CID:	127298530
Reduced:	SO2N3C21H29 (1)
Stoich.:	AB2C3D21E29 (1)
Weight, g/mol:	377.304228
ΔH_f, kcal/mol:	-58.74
Dipole, Da:	4.16
IP(EA), eV:	-8.79(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(2-cyclopentylacetyl)amino]piperidin-1-yl]-N-(4-methylcyclohexyl)propanamide

Drug info:

PubChemData

Smile

CC1=C(N=C(O1)C2=CSC=C2)CN3CCC(CC3)NC(=O)CC4CCCC4

DOS

IR

Vibrations