Geometry & MOs

Info

ID:	416380
PubChem CID:	135089393
Reduced:	N3O3C24H35 (1)
Stoich.:	A3B3C24D35 (1)
Weight, g/mol:	343.189592
ΔH_f, kcal/mol:	-125.34
Dipole, Da:	9.31
IP(EA), eV:	-8.91(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(4-methylpiperidin-1-yl)propylamino]-5-phenyl-1,2-oxazole-4-carboxylic acid

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(=O)COC2=CC=C(C=C2)CN(C)[C@@H]3C[C@@H]4CC(=O)NC[C@@H]4C3

DOS

IR

Vibrations