Geometry & MOs

Info

ID:	26459
PubChem CID:	649037
Reduced:	SN2O5H12C13 (1)
Stoich.:	AB2C5D12E13 (1)
Weight, g/mol:	326.199428
ΔH_f, kcal/mol:	-168.25
Dipole, Da:	2.85
IP(EA), eV:	-8.5(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-piperidin-1-yl-3-(piperidin-1-ylmethyl)chromen-2-one

Drug info:

PubChemData

Smile

C1COC2=C(O1)C=CC(=C2)NC(=O)CN3C(=O)CSC3=O

DOS

IR

Vibrations