Geometry & MOs

Info

ID:

45607

PubChem CID:

10515525

Reduced:

OSiC16H24 (1)

Stoich.:

ABC16D24 (1)

Weight, g/mol:

261.038846

ΔHf, kcal/mol:

-50.64

Dipole, Da:

3.43

IP(EA), eV:

-8.94(0.09)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-(1,1,2,2,3,3,3-heptafluoropropyl)aniline

Drug info:

PubChemData

Smile

CC(C)/C=C/[C@@H](CC=O)[Si](C)(C)C1=CC=CC=C1

DOS

IR

Vibrations