Geometry & MOs

Info

ID:	28538
PubChem CID:	828231
Reduced:	ClON2H15C18 (1)
Stoich.:	ABC2D15E18 (1)
Weight, g/mol:	279.173548
ΔH_f, kcal/mol:	23.48
Dipole, Da:	9.96
IP(EA), eV:	-8.97(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-diethyl-4-(3-imino-1H-isoindol-2-yl)aniline

Drug info:

PubChemData

Smile

CC1=C(C(=O)N=C(N1C2=CC=CC=C2Cl)C)C3=CC=CC=C3

DOS

IR

Vibrations