Geometry & MOs

Info

ID:	124340
PubChem CID:	50879599
Reduced:	N2O2C7H10 (2)
Stoich.:	A2B2C7D10 (2)
Weight, g/mol:	299.071306
ΔH_f, kcal/mol:	-59.38
Dipole, Da:	9.45
IP(EA), eV:	-9.25(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,2-dihydroacenaphthylen-5-yl)-5-oxopyrrolidine-3-carbonyl chloride

Drug info:

PubChemData

Smile

CC1CCN(CC1)C2=C(C=C(C(=C2)OC)C(=O)NN)[N+](=O)[O-]

DOS

IR

Vibrations