Geometry & MOs

Info

ID:	349026
PubChem CID:	127274752
Reduced:	SN2O3C16H24 (1)
Stoich.:	AB2C3D16E24 (1)
Weight, g/mol:	388.247441
ΔH_f, kcal/mol:	-95.07
Dipole, Da:	3.03
IP(EA), eV:	-8.82(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-methyl-1-[4-(morpholin-4-ylmethyl)piperidin-1-yl]-1-oxobutan-2-yl]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=C1)C2CCCN2C(=O)CSCC3CCCCO3

DOS

IR

Vibrations