Geometry & MOs

Info

ID:	359194
PubChem CID:	127297611
Reduced:	SN3O3C12H23 (1)
Stoich.:	AB3C3D12E23 (1)
Weight, g/mol:	261.139865
ΔH_f, kcal/mol:	-147.25
Dipole, Da:	6.14
IP(EA), eV:	-9.48(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclohexylsulfonyl-2-methyl-1,4-oxazepane

Drug info:

PubChemData

Smile

C1CCC(CC1)S(=O)(=O)N2CCCN(CC2)C(=O)N

DOS

IR

Vibrations