Geometry & MOs

Info

ID:	191385
PubChem CID:	78141986
Reduced:	NSF3O4C17H20 (1)
Stoich.:	ABC3D4E17F20 (1)
Weight, g/mol:	337.134779
ΔH_f, kcal/mol:	-295.16
Dipole, Da:	2.67
IP(EA), eV:	-9.98(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 6-[(3-methylphenyl)sulfonylamino]hexa-2,4-dienoate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)C=CC=CCNS(=O)(=O)C1=CC=C(C=C1)C(F)(F)F

DOS

IR

Vibrations