Geometry & MOs

Info

ID:	257779
PubChem CID:	103148548
Reduced:	ClNOF4C13H16 (1)
Stoich.:	ABCD4E13F16 (1)
Weight, g/mol:	257.160263
ΔH_f, kcal/mol:	-246.24
Dipole, Da:	4.14
IP(EA), eV:	-9.46(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-1-propan-2-yloxy-4-(2,2,2-trifluoroethoxy)butan-2-amine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations