Geometry & MOs

Info

ID:

159449

PubChem CID:

57280212

Reduced:

OSiCl2C4H9 (1)

Stoich.:

ABC2D4E9 (1)

Weight, g/mol:

221.964

ΔHf, kcal/mol:

-95.77

Dipole, Da:

2.44

IP(EA), eV:

0.0(0.0)

Spin(Sz, S2):

0.500000, 0.756437

Charge, e:

0

Chem-info

IUPAC name:

(2S)-2-amino-2-[(5S)-3-bromo-2,5-dihydro-1,2-oxazol-5-yl]acetic acid

Drug info:

PubChemData

Smile

CC(C)OC[Si](Cl)Cl

DOS

IR

Vibrations