Geometry & MOs

Info

ID:	257737
PubChem CID:	103148420
Reduced:	NOF5C13H16 (1)
Stoich.:	ABC5D13E16 (1)
Weight, g/mol:	343.05071
ΔH_f, kcal/mol:	-287.04
Dipole, Da:	4.8
IP(EA), eV:	-9.35(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-bromo-2-ethylpyrazol-3-yl)-N-methyl-3-(2,2,2-trifluoroethoxy)propan-1-amine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations