Geometry & MOs

Info

ID:	364094
PubChem CID:	127313883
Reduced:	SN3O4C16H31 (1)
Stoich.:	AB3C4D16E31 (1)
Weight, g/mol:	359.224263
ΔH_f, kcal/mol:	-185.64
Dipole, Da:	4.38
IP(EA), eV:	-8.81(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-N-methyl-4-(oxan-4-ylmethyl)piperazine-1-sulfonamide

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)S(=O)(=O)N2CCN(CC2)CC3CCOCC3

DOS

IR

Vibrations