Geometry & MOs

Info

ID:

400822

PubChem CID:

135049170

Reduced:

ON2C11H14 (2)

Stoich.:

AB2C11D14 (2)

Weight, g/mol:

676.146901

ΔHf, kcal/mol:

134.01

Dipole, Da:

1.26

IP(EA), eV:

-4.71(-2.86)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(4R,5R)-1,3-bis[(4-nitrophenyl)sulfonyl]-2-[(E)-pent-2-en-3-yl]oxy-4,5-diphenyl-1,3,2-diazaborolidine

Drug info:

PubChemData

Smile

CC[C@](C)(C1=CC(=C(C=C1)OC)[N+]#N)[C@@](C)(CC)C2=CC(=C(C=C2)OC)[N+]#N

DOS

IR

Vibrations