Geometry & MOs

Info

ID:	349289
PubChem CID:	127275076
Reduced:	SN3O3C14H19 (1)
Stoich.:	AB3C3D14E19 (1)
Weight, g/mol:	346.225643
ΔH_f, kcal/mol:	-88.19
Dipole, Da:	7.58
IP(EA), eV:	-9.39(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-cyclopentyloxyphenyl)methyl]-2-(2-methyl-1,4-oxazepan-4-yl)acetamide

Drug info:

PubChemData

Smile

CC1CN(CCCO1)CC2=NS(=O)(=O)C3=CC=CC=C3N2

DOS

IR

Vibrations