Geometry & MOs

Info

ID:	282099
PubChem CID:	103915958
Reduced:	BrNO4C16H24 (1)
Stoich.:	ABC4D16E24 (1)
Weight, g/mol:	331.235873
ΔH_f, kcal/mol:	-173.77
Dipole, Da:	2.53
IP(EA), eV:	-9.24(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-ethyl-4-[2-(2-methoxyethoxy)ethoxy]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CC1(CCN(CC1)C(=O)OC(C)(C)C)OCC2=CC=C(O2)Br

DOS

IR

Vibrations