Geometry & MOs

Info

ID:	413528
PubChem CID:	135086477
Reduced:	BrNC8H9 (1)
Stoich.:	ABC8D9 (1)
Weight, g/mol:	267.162314
ΔH_f, kcal/mol:	26.45
Dipole, Da:	3.44
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.064165
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methoxy-3,5-dimethylphenyl)-1-(3-methylphenyl)ethanimine

Drug info:

PubChemData

Smile

CC(=[NH2+])C1=CC(=CC=C1)Br

DOS

IR

Vibrations