Geometry & MOs

Info

ID:	279748
PubChem CID:	103844995
Reduced:	ClFN2O2C16H24 (1)
Stoich.:	ABC2D2E16F24 (1)
Weight, g/mol:	358.121483
ΔH_f, kcal/mol:	-166.87
Dipole, Da:	2.82
IP(EA), eV:	-8.98(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-[(2,5-dichlorophenyl)methylamino]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCC(C)(C)NCC1=C(C=CC(=C1)Cl)F

DOS

IR

Vibrations