Geometry & MOs

Info

ID:	295547
PubChem CID:	117533496
Reduced:	BrNOC12H14 (1)
Stoich.:	ABCD12E14 (1)
Weight, g/mol:	243.1987
ΔH_f, kcal/mol:	-14.23
Dipole, Da:	2.76
IP(EA), eV:	-8.96(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,5-dimethylphenyl)-N-methylbicyclo[2.2.2]octan-1-amine

Drug info:

PubChemData

Smile

CN1CCC(C(=O)C1)C2=CC=CC=C2Br

DOS

IR

Vibrations