Geometry & MOs

Info

ID:

49454

PubChem CID:

11533044

Reduced:

ClOSF3N4H16C22 (1)

Stoich.:

ABCD3E4F16G22 (1)

Weight, g/mol:

477.197437

ΔHf, kcal/mol:

-107.45

Dipole, Da:

5.9

IP(EA), eV:

 -8.74(-1.6)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl (2S,3S)-4-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-[(2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl]oxypentanoate

Drug info:

PubChemData

Smile

CC1=C(C=CC(=N1)C(F)(F)F)C(=O)NC2=CC(=C(C=C2)Cl)C3=NC4=C(N3)C=C(C=C4)SC

DOS

IR

Vibrations