Geometry & MOs

Info

ID:	338687
PubChem CID:	127259698
Reduced:	NCl2C17H23 (1)
Stoich.:	AB2C17D23 (1)
Weight, g/mol:	297.105105
ΔH_f, kcal/mol:	2.36
Dipole, Da:	3.17
IP(EA), eV:	-8.51(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dichloro-N-[(3E)-3,7-dimethylocta-3,6-dienyl]aniline

Drug info:

PubChemData

Smile

CC(=CCC/C(=C/CN(C)C1=C(C=CC(=C1)Cl)Cl)/C)C

DOS

IR

Vibrations