Geometry & MOs

Info

ID:	165485
PubChem CID:	74555765
Reduced:	O3N4C22H30 (1)
Stoich.:	A3B4C22D30 (1)
Weight, g/mol:	224.060407
ΔH_f, kcal/mol:	-72.92
Dipole, Da:	2.78
IP(EA), eV:	-8.34(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(3-chloroprop-2-enoxy)phenyl]propan-1-one

Drug info:

PubChemData

Smile

CCOC(=O)N1CCN(CC1)CC2CNNC2C3=CC4=C(C=C3)C=C(C=C4)OC

DOS

IR

Vibrations