Geometry & MOs

Info

ID:	367710
PubChem CID:	127325488
Reduced:	SO2N5C16H23 (1)
Stoich.:	AB2C5D16E23 (1)
Weight, g/mol:	346.236876
ΔH_f, kcal/mol:	-58.15
Dipole, Da:	7.28
IP(EA), eV:	-8.79(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-methyl-1-[methyl-[(1-methylpiperidin-3-yl)methyl]amino]-1-oxobutan-2-yl]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC(=O)N1CCC(=O)N2CCN(CC2)CC3=NC=CN3)C

DOS

IR

Vibrations