Geometry & MOs

Info

ID:	270407
PubChem CID:	103636454
Reduced:	NOF4C13H17 (1)
Stoich.:	ABC4D13E17 (1)
Weight, g/mol:	248.113648
ΔH_f, kcal/mol:	-242.01
Dipole, Da:	5.53
IP(EA), eV:	-9.38(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-pyridin-3-yl-4-(2,2,2-trifluoroethoxy)butan-2-amine

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)F)C(CCOCC(F)(F)F)NC

DOS

IR

Vibrations