Geometry & MOs

Info

ID:

43524

PubChem CID:

10321421

Reduced:

F3O3N4C22H23 (1)

Stoich.:

A3B3C4D22E23 (1)

Weight, g/mol:

448.204588

ΔHf, kcal/mol:

-204.18

Dipole, Da:

4.21

IP(EA), eV:

 -9.71(-1.04)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[(2R)-2-(cyclopentylmethyl)-3-[2-[4-[2-hydroxyethyl(methyl)amino]-6-(trifluoromethyl)pyrimidin-2-yl]hydrazinyl]-3-oxopropyl]-N-hydroxyformamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)N[C@@H](CCCCCC(=O)NO)C2=NC3=C(N2)C=C(C=C3)C(F)(F)F

DOS

IR

Vibrations