Geometry & MOs

Info

ID:	288468
PubChem CID:	104317021
Reduced:	ON2C13H28 (1)
Stoich.:	AB2C13D28 (1)
Weight, g/mol:	230.235814
ΔH_f, kcal/mol:	-85.75
Dipole, Da:	2.98
IP(EA), eV:	-8.38(2.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(aminomethyl)pentan-3-yl-propylamino]butan-2-ol

Drug info:

PubChemData

Smile

CCCN(CCC(C)O)C1(CCCC1)CN

DOS

IR

Vibrations