Geometry & MOs

Info

ID:	3237
PubChem CID:	9373
Reduced:	ClNC11H14 (1)
Stoich.:	ABC11D14 (1)
Weight, g/mol:	195.081477
ΔH_f, kcal/mol:	40.65
Dipole, Da:	5.27
IP(EA), eV:	-9.68(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-N-methylprop-2-yn-1-amine;hydrochloride

Drug info:

PubChemData

Smile

CN(CC#C)CC1=CC=CC=C1.Cl

DOS

IR

Vibrations