Geometry & MOs

Info

ID:	433183
PubChem CID:	135173320
Reduced:	NS2O5C9H19 (1)
Stoich.:	AB2C5D9E19 (1)
Weight, g/mol:	393.107993
ΔH_f, kcal/mol:	-233.67
Dipole, Da:	2.23
IP(EA), eV:	-9.61(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-fluoro-1-propan-2-ylsulfonylpiperidin-4-yl)methyl 4-methylbenzenesulfonate

Drug info:

PubChemData

Smile

CCS(=O)(=O)N1CCC(CC1)COS(=O)(=O)C

DOS

IR

Vibrations