Geometry & MOs

Info

ID:	314636
PubChem CID:	126622533
Reduced:	BrON7H20C24 (1)
Stoich.:	ABC7D20E24 (1)
Weight, g/mol:	264.163791
ΔH_f, kcal/mol:	110.52
Dipole, Da:	7.48
IP(EA), eV:	-9.04(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-N-(4-phenylbutyl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)C2=NC(=C3C(=N2)N(C=N3)CC4=CC=C(C=C4)OC)NC5=CC(=NC=C5)Br

DOS

IR

Vibrations