Geometry & MOs

Info

ID:	185137
PubChem CID:	77260712
Reduced:	NSO7C22H23 (1)
Stoich.:	ABC7D22E23 (1)
Weight, g/mol:	211.100857
ΔH_f, kcal/mol:	-249.36
Dipole, Da:	3.41
IP(EA), eV:	-9.22(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(4-fluorophenoxy)pyrrolidin-2-yl]methanol

Drug info:

PubChemData

Smile

CC(=O)OC1CSC(C(C1OC(=O)C)OC(=O)C)OC2=CN=CC(=C2)C3=CC=CC=C3

DOS

IR

Vibrations