Geometry & MOs

Info

ID:	15301
PubChem CID:	436559
Reduced:	NOC21H21 (1)
Stoich.:	ABC21D21 (1)
Weight, g/mol:	303.162314
ΔH_f, kcal/mol:	9.11
Dipole, Da:	2.67
IP(EA), eV:	-8.82(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-phenanthren-2-yl-2-piperidin-1-ylethanone

Drug info:

PubChemData

Smile

C1CCN(CC1)CC(=O)C2=CC3=C(C=C2)C4=CC=CC=C4C=C3

DOS

IR

Vibrations