Geometry & MOs

Info

ID:	386446
PubChem CID:	134981774
Reduced:	OC6H7 (4)
Stoich.:	AB6C7 (4)
Weight, g/mol:	239.1674
ΔH_f, kcal/mol:	-135.24
Dipole, Da:	1.3
IP(EA), eV:	-9.01(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10-methyl-9-phenyl-9-azabicyclo[6.2.1]undeca-1(10),8(11)-diene

Drug info:

PubChemData

Smile

COC1=C2CCCCC(=O)C3=CC(=C(C=C3)OC)CCCCC(=O)C(=C2)C=C1

DOS

IR

Vibrations