Geometry & MOs

Info

ID:	21256
PubChem CID:	587794
Reduced:	ClO2N3H12C14 (1)
Stoich.:	AB2C3D12E14 (1)
Weight, g/mol:	289.061804
ΔH_f, kcal/mol:	59.88
Dipole, Da:	9.24
IP(EA), eV:	-8.82(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-2-methyl-N-[(4-nitrophenyl)methylideneamino]aniline

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)Cl)NN=CC2=CC=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations