Geometry & MOs

Info

ID:	155467
PubChem CID:	56365745
Reduced:	SO3N4C24H32 (1)
Stoich.:	AB3C4D24E32 (1)
Weight, g/mol:	417.205242
ΔH_f, kcal/mol:	-102.71
Dipole, Da:	4.15
IP(EA), eV:	-9.31(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-benzoylpiperidin-4-yl)-5-phenyl-N-propyl-1,2-oxazole-3-carboxamide

Drug info:

PubChemData

Smile

CCCN(C1CCN(CC1)C(=O)C2=CC=CC=C2)C(=O)CCC3=C(NC(=NC3=O)SC)C

DOS

IR

Vibrations