Geometry & MOs

Info

ID:	247656
PubChem CID:	103072590
Reduced:	NOC5H7 (2)
Stoich.:	ABC5D7 (2)
Weight, g/mol:	222.136828
ΔH_f, kcal/mol:	-44.41
Dipole, Da:	2.21
IP(EA), eV:	-9.06(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-[(propan-2-ylamino)methyl]prop-2-enyl]-3-azabicyclo[3.1.0]hexane-2,4-dione

Drug info:

PubChemData

Smile

CNCC(=C)CN1C(=O)C2CC2C1=O

DOS

IR

Vibrations