Geometry & MOs

Info

ID:	205332
PubChem CID:	80086923
Reduced:	BrClN2C11H16 (1)
Stoich.:	ABC2D11E16 (1)
Weight, g/mol:	261.24565
ΔH_f, kcal/mol:	1.17
Dipole, Da:	3.84
IP(EA), eV:	-8.41(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-2-(3-methylphenyl)-N-(2-methylpropyl)pentan-1-amine

Drug info:

PubChemData

Smile

CCC(C)(CN)NC1=CC(=C(C=C1)Cl)Br

DOS

IR

Vibrations