Geometry & MOs

Info

ID:

185877

PubChem CID:

77364564

Reduced:

NO9C42H49 (1)

Stoich.:

AB9C42D49 (1)

Weight, g/mol:

522.263552

ΔHf, kcal/mol:

-288.58

Dipole, Da:

6.52

IP(EA), eV:

-9.21(-0.26)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1CN2CC(C(C(C2C1O)O)OC3C(C(C(C(O3)COCC4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)OCC7=CC=CC=C7)O

DOS

IR

Vibrations