Geometry & MOs

Info

ID:	353744
PubChem CID:	127285321
Reduced:	FSO2N5C18H24 (1)
Stoich.:	ABC2D5E18F24 (1)
Weight, g/mol:	397.272927
ΔH_f, kcal/mol:	-41.18
Dipole, Da:	7.4
IP(EA), eV:	-8.98(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[cyclohexyl(phenyl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=NN=C(N1C2CC2)CN3CCCC(C3)NS(=O)(=O)C4=CC=CC(=C4)F

DOS

IR

Vibrations