Geometry & MOs

Info

ID:	406718
PubChem CID:	135078445
Reduced:	NO2C12H19 (1)
Stoich.:	AB2C12D19 (1)
Weight, g/mol:	408.114378
ΔH_f, kcal/mol:	-41.04
Dipole, Da:	2.42
IP(EA), eV:	-9.11(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(Z)-4-(1,3-dioxoisoindol-2-yl)but-2-enyl]-4-methyl-N-prop-2-ynylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)OC)N(CC=C)CC#C

DOS

IR

Vibrations