Geometry & MOs

Info

ID:	446830
PubChem CID:	135278050
Reduced:	NC13H19 (2)
Stoich.:	AB13C19 (2)
Weight, g/mol:	314.165763
ΔH_f, kcal/mol:	35.28
Dipole, Da:	2.89
IP(EA), eV:	-7.91(0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2E,4Z,7Z)-1,1,1-trifluoro-5-(1-fluoroprop-2-enyl)-2-methyl-7-prop-2-enylideneundeca-2,4,8-triene

Drug info:

PubChemData

Smile

CCC1=C(C=CC(=C1)N(C)C)[C@@H]2CC=C(C=C2)CCN(C(C)C)C(=C)/C=C\C

DOS

IR

Vibrations