Geometry & MOs

Info

ID:	316068
PubChem CID:	126629906
Reduced:	N5O6C31H43 (1)
Stoich.:	A5B6C31D43 (1)
Weight, g/mol:	189.076534
ΔH_f, kcal/mol:	-242.88
Dipole, Da:	4.59
IP(EA), eV:	-8.74(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4Z,6E)-1,1,1-trifluoronona-4,6,8-trien-3-imine

Drug info:

PubChemData

Smile

C[C@H](C1=NC2=C(C=CC(=C2)C=C)C=C1)OC(=O)C3CCCN(N3)C(=O)[C@H](C)NC(=O)C(C(C)C)NC(=O)OC(C)(C)C

DOS

IR

Vibrations