Geometry & MOs

Info

ID:	386464
PubChem CID:	134981831
Reduced:	O2C21H30 (1)
Stoich.:	A2B21C30 (1)
Weight, g/mol:	255.162314
ΔH_f, kcal/mol:	-63.33
Dipole, Da:	2.71
IP(EA), eV:	-8.8(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,5R,7S)-5-(diethylamino)-7-phenylbicyclo[3.2.0]hept-2-en-6-one

Drug info:

PubChemData

Smile

CCCC#CC1=C(CCCC1)C(=C=CC(C)(C)C(=O)OCC)C

DOS

IR

Vibrations