Geometry & MOs

Info

ID:	347677
PubChem CID:	127272543
Reduced:	SN3O3C20H35 (1)
Stoich.:	AB3C3D20E35 (1)
Weight, g/mol:	396.244664
ΔH_f, kcal/mol:	-156.47
Dipole, Da:	8.08
IP(EA), eV:	-8.99(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-N-(1,1-dioxothiolan-3-yl)-2-(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)acetamide

Drug info:

PubChemData

Smile

CC1(CC2CC(C1)(CN2CC(=O)N3CCN(CC3)C4CCS(=O)(=O)C4)C)C

DOS

IR

Vibrations