Geometry & MOs

Info

ID:	270650
PubChem CID:	103637460
Reduced:	ON2C8H14 (2)
Stoich.:	AB2C8D14 (2)
Weight, g/mol:	388.08201
ΔH_f, kcal/mol:	-84.84
Dipole, Da:	2.0
IP(EA), eV:	-9.01(0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-[[(4-bromothiophen-2-yl)methylamino]methyl]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCCC(C1)CNCC2=CN(N=C2)C

DOS

IR

Vibrations