Geometry & MOs

Info

ID:	143850
PubChem CID:	53269531
Reduced:	ClN2O2H11C13 (1)
Stoich.:	AB2C2D11E13 (1)
Weight, g/mol:	276.066555
ΔH_f, kcal/mol:	22.7
Dipole, Da:	6.08
IP(EA), eV:	-8.91(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-(4-ethylphenyl)-2-nitroaniline

Drug info:

PubChemData

Smile

CC1=CC=CC=C1NC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

DOS

IR

Vibrations