Geometry & MOs

Info

ID:

219994

PubChem CID:

85165123

Reduced:

N2O7C36H56 (1)

Stoich.:

A2B7C36D56 (1)

Weight, g/mol:

628.463535

ΔHf, kcal/mol:

-375.62

Dipole, Da:

13.33

IP(EA), eV:

 -9.76(0.35)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[[6-[tert-butyl(dimethyl)silyl]oxy-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-3-yl]oxy]-2-diazonioethenolate

Drug info:

PubChemData

Smile

CC(C(=O)O)NC(=O)C1(C2CCC3(C(C2(CCC1O)C)CCC4C3(CCC5(C4C(CC5)C(=C)C)C(=O)NC(C)C(=O)O)C)C)C

DOS

IR

Vibrations