Geometry & MOs

Info

ID:	353590
PubChem CID:	127285167
Reduced:	N3O4C21H27 (1)
Stoich.:	A3B4C21D27 (1)
Weight, g/mol:	395.224263
ΔH_f, kcal/mol:	-163.21
Dipole, Da:	4.66
IP(EA), eV:	-8.92(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-N-methyl-2-[2-oxo-2-[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]ethyl]sulfanylacetamide

Drug info:

PubChemData

Smile

C1CC(OC1)C(=O)NC2=CC=CC(=C2)C(=O)N3CCC(CC3)N4CCCC4=O

DOS

IR

Vibrations