Geometry & MOs

Info

ID:	259569
PubChem CID:	103168437
Reduced:	NOCl2C17H25 (1)
Stoich.:	ABC2D17E25 (1)
Weight, g/mol:	259.23
ΔH_f, kcal/mol:	-60.28
Dipole, Da:	1.7
IP(EA), eV:	-8.99(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-tert-butylphenyl)-3-cyclobutyl-N-methylpropan-2-amine

Drug info:

PubChemData

Smile

CCNC(CC1CC(C1)OCC)CC2=C(C=C(C=C2)Cl)Cl

DOS

IR

Vibrations