Geometry & MOs

Info

ID:	73618
PubChem CID:	48419519
Reduced:	BrON3C14H22 (1)
Stoich.:	ABC3D14E22 (1)
Weight, g/mol:	268.072703
ΔH_f, kcal/mol:	-39.14
Dipole, Da:	2.78
IP(EA), eV:	-9.44(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-(1-methylpyrazol-4-yl)propanamide

Drug info:

PubChemData

Smile

CC1=NN(C(=C1Br)C(=O)NCCC2CCCCC2)C

DOS

IR

Vibrations