Geometry & MOs

Info

ID:	319218
PubChem CID:	126655346
Reduced:	ON3C8H13 (1)
Stoich.:	AB3C8D13 (1)
Weight, g/mol:	167.105862
ΔH_f, kcal/mol:	-15.17
Dipole, Da:	3.23
IP(EA), eV:	-9.43(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-1-(1H-pyrazol-5-yl)pyrrolidin-3-ol

Drug info:

PubChemData

Smile

C[C@@]1(CCN(C1)C2=CC=NN2)O

DOS

IR

Vibrations