Geometry & MOs

Info

ID:

219564

PubChem CID:

85149194

Reduced:

PCl2N3O5C26H34 (1)

Stoich.:

AB2C3D5E26F34 (1)

Weight, g/mol:

572.274718

ΔHf, kcal/mol:

-264.15

Dipole, Da:

6.85

IP(EA), eV:

 -9.19(-0.37)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[3-[1-[(2-amino-2-methylpropanoyl)amino]-2-[(2-phenylphenyl)methoxy]ethyl]-[1,2,4]triazolo[4,3-a]pyridin-5-yl]methyl morpholine-4-carboxylate

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N1CCCC1C(=O)NC(C(C)C)P(=O)(OC2=CC=C(C=C2)Cl)OC3=CC=C(C=C3)Cl)N

DOS

IR

Vibrations