Geometry & MOs

Info

ID:	247012
PubChem CID:	103066426
Reduced:	NOC13H19 (1)
Stoich.:	ABC13D19 (1)
Weight, g/mol:	303.00255
ΔH_f, kcal/mol:	-15.48
Dipole, Da:	2.3
IP(EA), eV:	-8.62(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-bromo-2-chlorophenoxy)methyl]-N-ethylprop-2-en-1-amine

Drug info:

PubChemData

Smile

CCC1=CC(=CC=C1)OCC(=C)CNC

DOS

IR

Vibrations