Geometry & MOs

Info

ID:

376593

PubChem CID:

134222613

Reduced:

ON9C51H99 (1)

Stoich.:

AB9C51D99 (1)

Weight, g/mol:

726.672393

ΔHf, kcal/mol:

-108.13

Dipole, Da:

3.3

IP(EA), eV:

 -8.13(0.33)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-butyl-4-methyl-6-[2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-2-(2,2,6,6-tetramethylpiperidin-4-yl)hydrazinyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine

Drug info:

PubChemData

Smile

CCCCN(C1CC(N(C(C1)(C)C)OCCC)(C)C)C2=NC(=NC(=N2)C)N(CCCCCCN(C)C3CC(N(C(C3)(C)C)CCC)(C)C)C4CC(N(C(C4)(C)C)CCC)(C)C

DOS

IR

Vibrations