Geometry & MOs

Info

ID:	332365
PubChem CID:	127250651
Reduced:	O3N5C22H27 (1)
Stoich.:	A3B5C22D27 (1)
Weight, g/mol:	437.24269
ΔH_f, kcal/mol:	-58.37
Dipole, Da:	5.53
IP(EA), eV:	-9.34(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-5-[6-[4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]morpholin-2-yl]pyridin-3-yl]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)C1=NC=C(C=C1)C2=CN=C(C=C2)C3CN(CCO3)CC(=O)N4CCCC4

DOS

IR

Vibrations