Geometry & MOs

Info

ID:

390883

PubChem CID:

135001430

Reduced:

SO2C11H12 (1)

Stoich.:

AB2C11D12 (1)

Weight, g/mol:

319.193614

ΔHf, kcal/mol:

-32.99

Dipole, Da:

6.35

IP(EA), eV:

-9.85(-0.13)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(2E)-4-benzhydryl-N-tert-butylpenta-2,4-dienamide

Drug info:

PubChemData

Smile

CS(=O)(=O)/C=C/C=C\C1=CC=CC=C1

DOS

IR

Vibrations