Geometry & MOs

Info

ID:	394972
PubChem CID:	135024332
Reduced:	NNiPC3H10 (1)
Stoich.:	ABCD3E10 (1)
Weight, g/mol:	394.00415
ΔH_f, kcal/mol:	103.73
Dipole, Da:	3.33
IP(EA), eV:	-8.07(0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-7,7,7-trifluoro-6-iodo-2-methylhept-5-en-3-yn-2-yl]oxymethylbenzene

Drug info:

PubChemData

Smile

[CH3-].C(CP)[NH-].[Ni+2]

DOS

IR

Vibrations