Geometry & MOs

Info

ID:	39231
PubChem CID:	8139955
Reduced:	NOC11H15 (2)
Stoich.:	ABC11D15 (2)
Weight, g/mol:	380.197417
ΔH_f, kcal/mol:	-57.15
Dipole, Da:	3.26
IP(EA), eV:	-8.77(0.08)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[2-[[4-(1,3-dioxoisoindol-2-yl)butanoylamino]methyl]phenyl]methyl-dimethylazanium

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NCC2=CC=CC=C2CN(C)C

DOS

IR

Vibrations