Geometry & MOs

Info

ID:	330623
PubChem CID:	127248030
Reduced:	N2O3C20H26 (1)
Stoich.:	A2B3C20D26 (1)
Weight, g/mol:	322.169271
ΔH_f, kcal/mol:	-107.37
Dipole, Da:	5.1
IP(EA), eV:	-8.99(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-fluoro-4-methoxyphenyl)-[3-hydroxy-3-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)C(=CO2)CC(=O)N3CCC(C3)(CN4CCCC4)O

DOS

IR

Vibrations