Geometry & MOs

Info

ID:	362750
PubChem CID:	127309296
Reduced:	SO2N4C17H28 (1)
Stoich.:	AB2C4D17E28 (1)
Weight, g/mol:	349.247775
ΔH_f, kcal/mol:	-69.89
Dipole, Da:	4.5
IP(EA), eV:	-8.77(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-propylpiperidin-4-yl)methyl]-2-(pyrazol-1-ylmethyl)morpholine-4-carboxamide

Drug info:

PubChemData

Smile

CCCN1CCC(CC1)CNC(=O)N2CCOC(C2)C3=NC=CS3

DOS

IR

Vibrations