Geometry & MOs

Info

ID:

214897

PubChem CID:

85083815

Reduced:

N6O13C26H32 (1)

Stoich.:

A6B13C26D32 (1)

Weight, g/mol:

636.235968

ΔHf, kcal/mol:

-464.98

Dipole, Da:

9.94

IP(EA), eV:

 -8.55(-1.37)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[1,5-bis(4-fluorophenyl)-5-(hydroxyamino)-3-hydroxyiminopentyl]-N-[1,5-bis(4-fluorophenyl)-3-hydroxyiminopent-4-enyl]hydroxylamine

Drug info:

PubChemData

Smile

CC1=C(N2C(=O)C3=C(N(C2=N1)C)N(C=N3)OC4C(C(C(O4)COC(=O)C)OC(=O)C)OC(=O)C)CCC(C(=O)O)NC(=O)OC

DOS

IR

Vibrations