Geometry & MOs

Info

ID:	156993
PubChem CID:	56404807
Reduced:	O4N5C23H31 (1)
Stoich.:	A4B5C23D31 (1)
Weight, g/mol:	443.314792
ΔH_f, kcal/mol:	-136.12
Dipole, Da:	4.01
IP(EA), eV:	-9.08(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-tert-butyl-N-[1-[4-[(2,6-dimethylmorpholin-4-yl)methyl]piperidin-1-yl]-1-oxopropan-2-yl]benzamide

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)CC2CCN(CC2)C(=O)C3=CC4=C(N=C3)N(C(=O)NC4=O)C5CC5

DOS

IR

Vibrations