Geometry & MOs

Info

ID:	257784
PubChem CID:	103148576
Reduced:	ON2F3C13H19 (1)
Stoich.:	AB2C3D13E19 (1)
Weight, g/mol:	307.187147
ΔH_f, kcal/mol:	-188.41
Dipole, Da:	5.25
IP(EA), eV:	-9.39(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-1-(2-ethyl-5-methylpyrazol-3-yl)-4-(2,2,2-trifluoroethoxy)butan-2-amine

Drug info:

PubChemData

Smile

CCNC(CCOCC(F)(F)F)C1=CN=CC(=C1)C

DOS

IR

Vibrations