Geometry & MOs

Info

ID:	447569
PubChem CID:	135283903
Reduced:	N2F3O4H11C12 (1)
Stoich.:	A2B3C4D11E12 (1)
Weight, g/mol:	337.205322
ΔH_f, kcal/mol:	-291.66
Dipole, Da:	6.49
IP(EA), eV:	-10.02(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-(4-fluorophenyl)-4-(2-hydroxypropan-2-yl)piperidine-1-carboxylate

Drug info:

PubChemData

Smile

C1=CC(=NC(=C1)NC(=O)O)C(=O)CC(CC=O)C(F)(F)F

DOS

IR

Vibrations