Geometry & MOs

Info

ID:

217287

PubChem CID:

85087555

Reduced:

NO7C17H19 (1)

Stoich.:

AB7C17D19 (1)

Weight, g/mol:

349.095023

ΔHf, kcal/mol:

-178.19

Dipole, Da:

7.17

IP(EA), eV:

-8.64(-1.16)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2,8-dihydroxy-6-phenylmethoxy-5,10b-dihydrophenanthridine-3,7-dione

Drug info:

PubChemData

Smile

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)OCC(CO[N+](=O)[O-])O

DOS

IR

Vibrations