Geometry & MOs

Info

ID:

432191

PubChem CID:

135172323

Reduced:

OF3C10H11 (1)

Stoich.:

AB3C10D11 (1)

Weight, g/mol:

720.312761

ΔHf, kcal/mol:

-167.15

Dipole, Da:

3.62

IP(EA), eV:

-8.91(-0.83)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1,3-thiazol-5-ylmethyl N-[(2S,3S)-3-hydroxy-5-[[(2S)-3-methyl-2-[[methyl-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]carbamoyl]amino]butanoyl]amino]-1,6-diphenylhexan-2-yl]carbamate

Drug info:

PubChemData

Smile

CCCC1=CC=COC(=C1)C(F)(F)F

DOS

IR

Vibrations