Geometry & MOs

Info

ID:	315979
PubChem CID:	126629542
Reduced:	N4O7C37H54 (1)
Stoich.:	A4B7C37D54 (1)
Weight, g/mol:	222.01716
ΔH_f, kcal/mol:	-302.36
Dipole, Da:	7.58
IP(EA), eV:	-9.12(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z,4Z)-2-chloro-3,4,5-trifluorohepta-2,4-dienimidoyl cyanide

Drug info:

PubChemData

Smile

CCCC(O)OC(C)C(/C=C/C1=CC2=C(C=C1)C=CC(=N2)CC)C(=O)CCC[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N3CCC[C@H](N3)C(=O)O

DOS

IR

Vibrations