Geometry & MOs

Info

ID:	269593
PubChem CID:	103618098
Reduced:	FN3O3C11H14 (1)
Stoich.:	AB3C3D11E14 (1)
Weight, g/mol:	378.066861
ΔH_f, kcal/mol:	-83.58
Dipole, Da:	6.28
IP(EA), eV:	-9.77(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-(2,4,5-trichloroanilino)piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CCCC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])F)N

DOS

IR

Vibrations