Geometry & MOs

Info

ID:	274549
PubChem CID:	103810112
Reduced:	BrOSN2C11H15 (1)
Stoich.:	ABCD2E11F15 (1)
Weight, g/mol:	246.136828
ΔH_f, kcal/mol:	-27.15
Dipole, Da:	3.73
IP(EA), eV:	-9.03(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(2,3-dihydro-1-benzofuran-3-yl)piperidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CCN[C@H](C1)C(=O)NCC2=C(C=CS2)Br

DOS

IR

Vibrations