Geometry & MOs

Info

ID:	256373
PubChem CID:	103138833
Reduced:	O2N3C16H19 (1)
Stoich.:	A2B3C16D19 (1)
Weight, g/mol:	279.199843
ΔH_f, kcal/mol:	-38.71
Dipole, Da:	3.59
IP(EA), eV:	-8.22(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-fluorophenyl)-3-(5-methyloxolan-2-yl)-N-propylpropan-1-amine

Drug info:

PubChemData

Smile

C1CN(CCC12OCCO2)C3=C4C=NC=CC4=C(C=C3)N

DOS

IR

Vibrations