Geometry & MOs

Info

ID:	78429
PubChem CID:	49689610
Reduced:	N3O4C23H29 (1)
Stoich.:	A3B4C23D29 (1)
Weight, g/mol:	417.189986
ΔH_f, kcal/mol:	-105.34
Dipole, Da:	7.47
IP(EA), eV:	-9.46(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4,5-trimethoxy-N-[[1-(5-methyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]methyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=NO1)C(=O)N2CCC(CC2)CNC(=O)C3(CCOCC3)C4=CC=CC=C4

DOS

IR

Vibrations