Geometry & MOs

Info

ID:	319299
PubChem CID:	126655554
Reduced:	FON3C7H10 (1)
Stoich.:	ABC3D7E10 (1)
Weight, g/mol:	261.12774
ΔH_f, kcal/mol:	-48.24
Dipole, Da:	2.55
IP(EA), eV:	-9.6(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-benzyl-4-fluoropyrazol-3-yl)pyrrolidin-3-ol

Drug info:

PubChemData

Smile

C1CN(CC1O)C2=C(C=NN2)F

DOS

IR

Vibrations