Geometry & MOs

Info

ID:	442316
PubChem CID:	135251302
Reduced:	N2O4C19H34 (1)
Stoich.:	A2B4C19D34 (1)
Weight, g/mol:	365.136254
ΔH_f, kcal/mol:	-236.82
Dipole, Da:	1.0
IP(EA), eV:	-9.37(0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1,1,1-trifluoro-3-hydroxypropan-2-yl] 2-(4-fluoropyrazol-1-yl)-7-azaspiro[3.5]nonane-7-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)N(C)[C@@H]1CC2(CCN(CC2)C(=O)OC(C)(C)C)OC1

DOS

IR

Vibrations