Geometry & MOs

Info

ID:	448626
PubChem CID:	135292329
Reduced:	NO4C25H31 (1)
Stoich.:	AB4C25D31 (1)
Weight, g/mol:	346.120509
ΔH_f, kcal/mol:	-72.52
Dipole, Da:	6.46
IP(EA), eV:	-8.7(-1.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,6-dimethyl-2-(prop-1-en-2-yloxymethyl)naphtho[1,2-g][1]benzofuran-10,11-dione

Drug info:

PubChemData

Smile

CCCC1=C(C2=C(C(=C)/C(=C(/C)\C=C/C)/C=C2)C(=O)C1=O)OC(=C)CN(C)CCO

DOS

IR

Vibrations