Geometry & MOs

Info

ID:	349342
PubChem CID:	127275129
Reduced:	FSN3O4C18H26 (1)
Stoich.:	ABC3D4E18F26 (1)
Weight, g/mol:	358.192629
ΔH_f, kcal/mol:	-193.87
Dipole, Da:	2.25
IP(EA), eV:	-9.02(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-N-(1,1-dioxothiolan-3-yl)-2-(2-methyl-1,4-oxazepan-4-yl)acetamide

Drug info:

PubChemData

Smile

CC1CN(CCCO1)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

DOS

IR

Vibrations