Geometry & MOs

Info

ID:	131565
PubChem CID:	51229184
Reduced:	SO2N4C18H24 (1)
Stoich.:	AB2C4D18E24 (1)
Weight, g/mol:	279.102606
ΔH_f, kcal/mol:	-34.53
Dipole, Da:	7.7
IP(EA), eV:	-8.46(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-chloro-2,3-dihydro-1-benzofuran-2-yl)-(3-methylpiperidin-1-yl)methanone

Drug info:

PubChemData

Smile

CC1CCCN(C1)C(=O)CCN2C(=NNC2=S)C3=CC=C(C=C3)OC

DOS

IR

Vibrations