Geometry & MOs

Info

ID:	270397
PubChem CID:	103636380
Reduced:	NOF3C9H18 (1)
Stoich.:	ABC3D9E18 (1)
Weight, g/mol:	367.07586
ΔH_f, kcal/mol:	-230.1
Dipole, Da:	2.97
IP(EA), eV:	-9.11(1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-bromophenyl)-N-propyl-4-(2,2,2-trifluoroethoxy)butan-2-amine

Drug info:

PubChemData

Smile

CCCC(CCOCC(F)(F)F)NC

DOS

IR

Vibrations