Geometry & MOs

Info

ID:	27622
PubChem CID:	822663
Reduced:	N3O4C16H23 (1)
Stoich.:	A3B4C16D23 (1)
Weight, g/mol:	325.110279
ΔH_f, kcal/mol:	-120.4
Dipole, Da:	4.87
IP(EA), eV:	-8.48(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1,2-dihydroacenaphthylen-5-ylamino)naphthalene-1,2-dione

Drug info:

PubChemData

Smile

CN(C)N1C(=O)C[C@@H](C1=O)NCCC2=CC(=C(C=C2)OC)OC

DOS

IR

Vibrations