Geometry & MOs

Info

ID:	205298
PubChem CID:	80082224
Reduced:	ON2C14H24 (1)
Stoich.:	AB2C14D24 (1)
Weight, g/mol:	238.184527
ΔH_f, kcal/mol:	-47.27
Dipole, Da:	4.34
IP(EA), eV:	-8.7(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(2-fluorophenyl)-N'-pentan-3-ylpropane-1,3-diamine

Drug info:

PubChemData

Smile

CCC(CC)OC1=C(N=C(C=C1)C)CNCC

DOS

IR

Vibrations