Geometry & MOs

Info

ID:	257366
PubChem CID:	103145552
Reduced:	SN3O4C13H19 (1)
Stoich.:	AB3C4D13E19 (1)
Weight, g/mol:	313.109627
ΔH_f, kcal/mol:	-86.29
Dipole, Da:	6.28
IP(EA), eV:	-9.54(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-dimethyl-4-nitrophenyl)piperidine-4-sulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1[N+](=O)[O-])C)NS(=O)(=O)CC2CCCN2

DOS

IR

Vibrations