Geometry & MOs

Info

ID:	64924
PubChem CID:	29204206
Reduced:	ON4C19H20 (1)
Stoich.:	AB4C19D20 (1)
Weight, g/mol:	444.183127
ΔH_f, kcal/mol:	38.72
Dipole, Da:	4.91
IP(EA), eV:	-9.44(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-N-(pyridin-3-ylmethyl)benzamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1CC2=CC=CC=C2)C)C(=O)NCC3=CN=CC=C3

DOS

IR

Vibrations