Geometry & MOs

Info

ID:	338697
PubChem CID:	127259708
Reduced:	NO3C18H19 (1)
Stoich.:	AB3C18D19 (1)
Weight, g/mol:	253.017353
ΔH_f, kcal/mol:	-29.07
Dipole, Da:	1.2
IP(EA), eV:	-8.54(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dichloro-N-[(E)-(5-methylimidazol-4-ylidene)methyl]aniline

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1OC)OC)N=C/C=C/C2=CC=CC=C2

DOS

IR

Vibrations