Geometry & MOs

Info

ID:	344010
PubChem CID:	127267186
Reduced:	ClSN3O5C12H16 (1)
Stoich.:	ABC3D5E12F16 (1)
Weight, g/mol:	347.09512
ΔH_f, kcal/mol:	-110.93
Dipole, Da:	4.67
IP(EA), eV:	-9.75(-2.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(5-fluoro-4-methyl-2-nitrophenyl)sulfonyl-3,3-dimethylbutanehydrazide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1S(=O)(=O)NNC(=O)CC(C)C)Cl)[N+](=O)[O-]

DOS

IR

Vibrations