Geometry & MOs

Info

ID:	270380
PubChem CID:	103636301
Reduced:	NOF3C16H24 (1)
Stoich.:	ABC3D16E24 (1)
Weight, g/mol:	315.040454
ΔH_f, kcal/mol:	-208.24
Dipole, Da:	4.7
IP(EA), eV:	-9.18(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,4-dichlorophenyl)-4-(2,2,2-trifluoroethoxy)butan-2-amine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations