Geometry & MOs

Info

ID:	230709
PubChem CID:	87571707
Reduced:	N2O2C17H20 (1)
Stoich.:	A2B2C17D20 (1)
Weight, g/mol:	233.177964
ΔH_f, kcal/mol:	-22.47
Dipole, Da:	0.79
IP(EA), eV:	-9.4(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[(E)-oct-5-enoxy]phenyl]methanamine

Drug info:

PubChemData

Smile

C#CCO[C@@H]1CC2=CC=CC=C2[C@@H]1NC(=O)C3CCCN3

DOS

IR

Vibrations