Geometry & MOs

Info

ID:	69661
PubChem CID:	47205106
Reduced:	OSN3H11C13 (1)
Stoich.:	ABC3D11E13 (1)
Weight, g/mol:	248.127326
ΔH_f, kcal/mol:	39.46
Dipole, Da:	5.41
IP(EA), eV:	-9.11(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(1H-pyrazol-5-ylmethyl)propanamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=C(S2)C(=O)NCC3=CC=NN3

DOS

IR

Vibrations