Geometry & MOs

Info

ID:	288466
PubChem CID:	104317000
Reduced:	ON2C8H20 (1)
Stoich.:	AB2C8D20 (1)
Weight, g/mol:	256.251464
ΔH_f, kcal/mol:	-67.62
Dipole, Da:	2.44
IP(EA), eV:	-8.75(2.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[1-(aminomethyl)-4-ethylcyclohexyl]-ethylamino]butan-2-ol

Drug info:

PubChemData

Smile

CCN(CCC(C)O)CCN

DOS

IR

Vibrations