Geometry & MOs

Info

ID:	343968
PubChem CID:	127267144
Reduced:	FSN3O5C13H18 (1)
Stoich.:	ABC3D5E13F18 (1)
Weight, g/mol:	345.07947
ΔH_f, kcal/mol:	-158.89
Dipole, Da:	2.29
IP(EA), eV:	-9.64(-2.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(2-fluoro-5-methyl-4-nitrophenyl)sulfonylcyclopentanecarbohydrazide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1[N+](=O)[O-])F)S(=O)(=O)NNC(=O)CC(C)(C)C

DOS

IR

Vibrations