Geometry & MOs

Info

ID:	417811
PubChem CID:	135102805
Reduced:	O2N5C22H29 (1)
Stoich.:	A2B5C22D29 (1)
Weight, g/mol:	330.157957
ΔH_f, kcal/mol:	-30.73
Dipole, Da:	10.04
IP(EA), eV:	-9.27(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CN(CCN(C1)C(=O)CC2CCC3=CC=CC=C23)C(=O)CCCN4C=NC=N4

DOS

IR

Vibrations