Geometry & MOs

Info

ID:	272104
PubChem CID:	103724071
Reduced:	NSO3C17H25 (1)
Stoich.:	ABC3D17E25 (1)
Weight, g/mol:	307.178358
ΔH_f, kcal/mol:	-149.29
Dipole, Da:	3.94
IP(EA), eV:	-9.38(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-[1-(furan-2-yl)-1-oxopropan-2-yl]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CC1=CC=C(S1)C(=O)CC2CCCCN2C(=O)OC(C)(C)C

DOS

IR

Vibrations