Geometry & MOs

Info

ID:	390218
PubChem CID:	134997833
Reduced:	BrO2C26H43 (1)
Stoich.:	AB2C26D43 (1)
Weight, g/mol:	263.224915
ΔH_f, kcal/mol:	-153.6
Dipole, Da:	3.78
IP(EA), eV:	-9.86(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-1-(2,6,6-trimethylcyclohexen-1-yl)ethanimine oxide

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCC[C@@H](C)[C@H](C1=CC=C(C=C1)Br)C(=O)O

DOS

IR

Vibrations