Geometry & MOs

Info

ID:	378994
PubChem CID:	134228795
Reduced:	NO2H29C34 (1)
Stoich.:	AB2C29D34 (1)
Weight, g/mol:	281.097127
ΔH_f, kcal/mol:	50.97
Dipole, Da:	2.59
IP(EA), eV:	-7.92(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-cyclohexa-1,5-dien-1-yl-N-phenylaniline

Drug info:

PubChemData

Smile

C/C=C\C1=C(C/C(=C(\C)/C2=CC=C(C=C2)NC3=CC=C(C=C3)C4=CC5=C(C=C4)OC6=CC=CC=C65)/O1)C

DOS

IR

Vibrations