Geometry & MOs

Info

ID:	257773
PubChem CID:	103148540
Reduced:	BrNOF4C14H18 (1)
Stoich.:	ABCD4E14F18 (1)
Weight, g/mol:	279.155847
ΔH_f, kcal/mol:	-251.7
Dipole, Da:	2.74
IP(EA), eV:	-7.89(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-1-(2-ethylpyrazol-3-yl)-3-(2,2,2-trifluoroethoxy)propan-1-amine

Drug info:

PubChemData

Smile

CCNC(CCOCC(F)(F)F)CC1=C(C=C(C=C1)F)Br

DOS

IR

Vibrations