Geometry & MOs

Info

ID:	353017
PubChem CID:	127284167
Reduced:	ON5C22H37 (1)
Stoich.:	AB5C22D37 (1)
Weight, g/mol:	346.236876
ΔH_f, kcal/mol:	-47.55
Dipole, Da:	6.62
IP(EA), eV:	-9.04(0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-(5-morpholin-4-ylpyridin-2-yl)-2-piperidin-1-ylbutanamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N1CCCC(C1)C2=NN=C3N2CCCCC3)N4CCCCC4

DOS

IR

Vibrations