Geometry & MOs

Info

ID:	20842
PubChem CID:	586078
Reduced:	NOC17H21 (1)
Stoich.:	ABC17D21 (1)
Weight, g/mol:	255.162314
ΔH_f, kcal/mol:	4.44
Dipole, Da:	3.3
IP(EA), eV:	-8.86(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(diethylamino)-7-phenylbicyclo[3.2.0]hept-2-en-6-one

Drug info:

PubChemData

Smile

CCN(CC)C12CC=CC1C(C2=O)C3=CC=CC=C3

DOS

IR

Vibrations