Geometry & MOs

Info

ID:	326440
PubChem CID:	126687552
Reduced:	ON4H22C26 (1)
Stoich.:	AB4C22D26 (1)
Weight, g/mol:	171.1987
ΔH_f, kcal/mol:	99.88
Dipole, Da:	5.29
IP(EA), eV:	-8.66(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5,6-trimethyloctan-4-amine

Drug info:

PubChemData

Smile

C/C=C\C=C(/C)\OC1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)C4=CC5=C(C=C4)N=CN5

DOS

IR

Vibrations