Geometry & MOs

Info

ID:	20478
PubChem CID:	584199
Reduced:	SN2O4C19H22 (1)
Stoich.:	AB2C4D19E22 (1)
Weight, g/mol:	374.130028
ΔH_f, kcal/mol:	-116.72
Dipole, Da:	4.99
IP(EA), eV:	-9.18(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-[[(4-methylphenyl)sulfonylhydrazinylidene]methyl]benzoate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NN=CC2=CC=C(C=C2)C(=O)OC(C)(C)C

DOS

IR

Vibrations