Geometry & MOs

Info

ID:

296771

PubChem CID:

117592053

Reduced:

NO6C39H43 (1)

Stoich.:

AB6C39D43 (1)

Weight, g/mol:

692.241993

ΔHf, kcal/mol:

-109.75

Dipole, Da:

3.95

IP(EA), eV:

 -8.67(-0.18)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-dimethylpropan-1-amine;2,3,9-trimethoxy-6H-chromeno[3,4-b]chromen-6a-ol;hydrochloride

Drug info:

PubChemData

Smile

CC12CCC3C(C1CCC2(C#C)O)CCC4=CC5=C(CC34C)C=NO5.COC1=CC2=C(C=C1)C3COC4=C(C3O2)C=CC(=C4)OC

DOS

IR

Vibrations