Geometry & MOs

Info

ID:	257790
PubChem CID:	103148613
Reduced:	NOF4C14H19 (1)
Stoich.:	ABC4D14E19 (1)
Weight, g/mol:	307.187147
ΔH_f, kcal/mol:	-245.72
Dipole, Da:	5.39
IP(EA), eV:	-9.28(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-1-(1-propan-2-ylpyrazol-3-yl)-4-(2,2,2-trifluoroethoxy)butan-2-amine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations