Geometry & MOs

Info

ID:	296433
PubChem CID:	117573958
Reduced:	N2O2C13H16 (1)
Stoich.:	A2B2C13D16 (1)
Weight, g/mol:	210.153227
ΔH_f, kcal/mol:	-30.7
Dipole, Da:	3.4
IP(EA), eV:	-8.24(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-N-(2-fluorophenyl)-N'-methylpropane-1,3-diamine

Drug info:

PubChemData

Smile

CC(C)C(CNC1=CC2=C(C=C1)OCO2)C#N

DOS

IR

Vibrations