Geometry & MOs

Info

ID:	76318
PubChem CID:	48424776
Reduced:	BrN2O2C18H25 (1)
Stoich.:	AB2C2D18E25 (1)
Weight, g/mol:	320.190006
ΔH_f, kcal/mol:	-58.23
Dipole, Da:	3.2
IP(EA), eV:	-8.44(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-[[1-(4-fluorophenyl)pyrrolidin-3-yl]methyl]propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NCC1CCN(C1)C2=CC(=CC=C2)Br)OCC3CC3

DOS

IR

Vibrations