Geometry & MOs

Info

ID:	339275
PubChem CID:	127260654
Reduced:	NO2C16H21 (1)
Stoich.:	AB2C16D21 (1)
Weight, g/mol:	329.039165
ΔH_f, kcal/mol:	-74.01
Dipole, Da:	7.0
IP(EA), eV:	-8.52(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-4-[(Z)-(2-oxocyclohexylidene)amino]oxysulfinylsulfonylbenzene

Drug info:

PubChemData

Smile

CC(=O)C1=CC=C(C=C1)N(C)CC2CCCCC2=O

DOS

IR

Vibrations