Geometry & MOs

Info

ID:	48957
PubChem CID:	11528521
Reduced:	NO3C10H15 (1)
Stoich.:	AB3C10D15 (1)
Weight, g/mol:	198.065635
ΔH_f, kcal/mol:	-132.85
Dipole, Da:	5.49
IP(EA), eV:	-9.12(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2E)-1,1,1-trifluoropenta-2,4-dien-2-yl]benzene

Drug info:

PubChemData

Smile

CCOC1(C2=CCCCN2C(=O)O1)C

DOS

IR

Vibrations