Geometry & MOs

Info

ID:	50483
PubChem CID:	12013024
Reduced:	NOC8H11 (2)
Stoich.:	ABC8D11 (2)
Weight, g/mol:	151.099714
ΔH_f, kcal/mol:	-64.98
Dipole, Da:	4.48
IP(EA), eV:	-9.39(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methylpropyl)-2-azabicyclo[2.2.0]hex-5-en-3-one

Drug info:

PubChemData

Smile

CCCN1C2C=CC(C1=O)C3C=CC2C(=O)N3CCC

DOS

IR

Vibrations