Geometry & MOs

Info

ID:	247034
PubChem CID:	103066667
Reduced:	BrNOC11H14 (1)
Stoich.:	ABCD11E14 (1)
Weight, g/mol:	197.060742
ΔH_f, kcal/mol:	1.41
Dipole, Da:	2.02
IP(EA), eV:	-9.13(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-chlorophenoxy)methyl]prop-2-en-1-amine

Drug info:

PubChemData

Smile

CNCC(=C)COC1=CC(=CC=C1)Br

DOS

IR

Vibrations