Geometry & MOs

Info

ID:	282122
PubChem CID:	103916308
Reduced:	NO4C18H27 (1)
Stoich.:	AB4C18D27 (1)
Weight, g/mol:	387.10452
ΔH_f, kcal/mol:	-188.27
Dipole, Da:	3.54
IP(EA), eV:	-8.72(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-[(5-bromofuran-2-yl)methoxy]-3-ethylpiperidine-1-carboxylate

Drug info:

PubChemData

Smile

CC1(CCN(C1)C(=O)OC(C)(C)C)OCC2=CC(=CC=C2)OC

DOS

IR

Vibrations