Geometry & MOs

Info

ID:	369307
PubChem CID:	127332304
Reduced:	S2O3N4C16H26 (1)
Stoich.:	A2B3C4D16E26 (1)
Weight, g/mol:	343.167811
ΔH_f, kcal/mol:	-76.74
Dipole, Da:	4.21
IP(EA), eV:	-9.13(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-methylpyrazol-4-yl)methyl]-1-morpholin-4-ylsulfonylpiperidin-4-amine

Drug info:

PubChemData

Smile

C1CC1C2=NC(=CS2)CNC3CCN(CC3)S(=O)(=O)N4CCOCC4

DOS

IR

Vibrations