Geometry & MOs

Info

ID:	39290
PubChem CID:	8140066
Reduced:	N2O4C21H22 (1)
Stoich.:	A2B4C21D22 (1)
Weight, g/mol:	366.181767
ΔH_f, kcal/mol:	-89.97
Dipole, Da:	1.82
IP(EA), eV:	-8.98(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[2-[[3-(1,3-dioxoisoindol-2-yl)propanoylamino]methyl]phenyl]methyl-dimethylazanium

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NN=C(O2)[C@@H](C)OC(=O)COC3=CC(=CC(=C3)C)C

DOS

IR

Vibrations