Geometry & MOs

Info

ID:	78397
PubChem CID:	49689465
Reduced:	O3N4C17H20 (1)
Stoich.:	A3B4C17D20 (1)
Weight, g/mol:	329.148789
ΔH_f, kcal/mol:	-42.32
Dipole, Da:	6.87
IP(EA), eV:	-9.6(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=NO1)C(=O)N2CCC(CC2)CNC(=O)C3=CC=CC=N3

DOS

IR

Vibrations