Geometry & MOs

Info

ID:	407961
PubChem CID:	135080716
Reduced:	NO3C10H15 (1)
Stoich.:	AB3C10D15 (1)
Weight, g/mol:	200.120115
ΔH_f, kcal/mol:	-129.87
Dipole, Da:	2.68
IP(EA), eV:	-10.21(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-phenylbicyclo[3.2.1]octan-2-one

Drug info:

PubChemData

Smile

CCC(C=C)OC(=O)N1CCCC1=O

DOS

IR

Vibrations