Geometry & MOs

Info

ID:	433954
PubChem CID:	135174101
Reduced:	BrFON2C19H22 (1)
Stoich.:	ABCD2E19F22 (1)
Weight, g/mol:	352.251464
ΔH_f, kcal/mol:	-44.53
Dipole, Da:	2.68
IP(EA), eV:	-8.94(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(2-phenylpropan-2-yl)phenoxy]-N-(pyrrolidin-3-ylmethyl)propan-1-amine

Drug info:

PubChemData

Smile

C1CNCCC1NCC2=CC=C(C=C2)OCC3=C(C=C(C=C3)Br)F

DOS

IR

Vibrations