Geometry & MOs

Info

ID:	149235
PubChem CID:	53788907
Reduced:	ON2C14H15 (2)
Stoich.:	AB2C14D15 (2)
Weight, g/mol:	285.092042
ΔH_f, kcal/mol:	16.02
Dipole, Da:	2.6
IP(EA), eV:	-7.56(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chlorophenyl)-3-[4-(dimethylamino)phenyl]prop-2-en-1-one

Drug info:

PubChemData

Smile

CN1CCN(CC1)C2=CC3=C(C4=C5C(=C3C=C2)C=CC(=C5C=CC4=C=O)N6CCN(CC6)C)O

DOS

IR

Vibrations