Geometry & MOs

Info

ID:

190634

PubChem CID:

78035301

Reduced:

FO2N7C36H46 (1)

Stoich.:

AB2C7D36E46 (1)

Weight, g/mol:

602.408358

ΔHf, kcal/mol:

-4.57

Dipole, Da:

9.02

IP(EA), eV:

 -8.94(-0.94)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-[1-[8-tert-butyl-2-[3-(4-methylpentoxy)phenyl]-3-oxo-1,4-diazaspiro[4.5]dec-1-en-4-yl]-4,4-dimethylpentyl]benzoic acid

Drug info:

PubChemData

Smile

CC(C)(C)CCC(C1=CC=C(C=C1)C(NCC2NNNN2)O)N3C(=O)C(=NC34CCC(CC4)C5=CC=CC=C5)C6=CC=C(C=C6)F

DOS

IR

Vibrations