Geometry & MOs

Info

ID:	429665
PubChem CID:	135169715
Reduced:	O2F3N8H17C22 (1)
Stoich.:	A2B3C8D17E22 (1)
Weight, g/mol:	265.070146
ΔH_f, kcal/mol:	-27.75
Dipole, Da:	6.46
IP(EA), eV:	-8.02(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-1-cyclopentyl-2-fluoro-N,N-bis(trifluoromethyl)ethenamine

Drug info:

PubChemData

Smile

COC1=C(NCC(=C1)NC(=O)C2=C(N(N=C2)C3=CC=CC4=C3C=CC=N4)C(F)(F)F)N5N=CC=N5

DOS

IR

Vibrations