Geometry & MOs

Info

ID:	257816
PubChem CID:	103148713
Reduced:	ClNOF4C14H18 (1)
Stoich.:	ABCD4E14F18 (1)
Weight, g/mol:	307.187147
ΔH_f, kcal/mol:	-251.16
Dipole, Da:	4.09
IP(EA), eV:	-9.47(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-ethylimidazol-2-yl)-N-propyl-4-(2,2,2-trifluoroethoxy)butan-2-amine

Drug info:

PubChemData

Smile

CCCNC(CCOCC(F)(F)F)C1=C(C=CC(=C1)F)Cl

DOS

IR

Vibrations