Geometry & MOs

Info

ID:	345147
PubChem CID:	127268907
Reduced:	SN2O5C18H26 (1)
Stoich.:	AB2C5D18E26 (1)
Weight, g/mol:	396.171893
ΔH_f, kcal/mol:	-198.43
Dipole, Da:	8.25
IP(EA), eV:	-9.32(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclohexyl-N-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)ethyl]acetamide

Drug info:

PubChemData

Smile

C1CCC(CC1)CC(=O)NCCNS(=O)(=O)C2=CC3=C(C=C2)OCCO3

DOS

IR

Vibrations