Geometry & MOs

Info

ID:	412844
PubChem CID:	135085773
Reduced:	NOC12H17 (1)
Stoich.:	ABC12D17 (1)
Weight, g/mol:	236.175185
ΔH_f, kcal/mol:	-22.26
Dipole, Da:	4.14
IP(EA), eV:	-9.2(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(trifluoromethyl)dodec-1-ene

Drug info:

PubChemData

Smile

CCCCC/C=C/C(=O)N1C=CC=C1

DOS

IR

Vibrations