Geometry & MOs

Info

ID:	85728
PubChem CID:	49878555
Reduced:	SO2N3C17H23 (1)
Stoich.:	AB2C3D17E23 (1)
Weight, g/mol:	253.052112
ΔH_f, kcal/mol:	-61.67
Dipole, Da:	3.9
IP(EA), eV:	-8.2(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-methoxy-1,2-oxazol-5-yl)-N-(1,3-thiazol-2-yl)propanamide

Drug info:

PubChemData

Smile

CCCN1CCN(CC1)C(=O)C(C)N2C(=O)C3=CC=CC=C3S2

DOS

IR

Vibrations