Geometry & MOs

Info

ID:	259571
PubChem CID:	103168469
Reduced:	NC20H33 (1)
Stoich.:	AB20C33 (1)
Weight, g/mol:	327.09979
ΔH_f, kcal/mol:	-23.78
Dipole, Da:	1.69
IP(EA), eV:	-8.76(0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-bromo-4-fluorophenyl)-3-cyclobutyl-N-propylpropan-2-amine

Drug info:

PubChemData

Smile

CCCNC(CC1CCC1)CC2=CC=C(C=C2)C(C)(C)C

DOS

IR

Vibrations