Geometry & MOs

Info

ID:	247049
PubChem CID:	103066929
Reduced:	NOC13H19 (1)
Stoich.:	ABC13D19 (1)
Weight, g/mol:	253.123342
ΔH_f, kcal/mol:	-10.16
Dipole, Da:	2.75
IP(EA), eV:	-8.87(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-chloro-5-methylphenoxy)methyl]-N-propan-2-ylprop-2-en-1-amine

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1OCC(=C)CNC

DOS

IR

Vibrations