Geometry & MOs

Info

ID:	269114
PubChem CID:	103614567
Reduced:	BrN2O2C15H23 (1)
Stoich.:	AB2C2D15E23 (1)
Weight, g/mol:	288.256549
ΔH_f, kcal/mol:	-54.19
Dipole, Da:	3.36
IP(EA), eV:	-8.69(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-methyl-N-(4-phenylcyclohexyl)-N'-propan-2-ylpropane-1,3-diamine

Drug info:

PubChemData

Smile

CC(C)N(C)CCCNCC1=CC2=C(C(=C1)Br)OCO2

DOS

IR

Vibrations