Geometry & MOs

Info

ID:	344110
PubChem CID:	127267286
Reduced:	F2O2N5C16H17 (1)
Stoich.:	A2B2C5D16E17 (1)
Weight, g/mol:	248.127326
ΔH_f, kcal/mol:	-78.34
Dipole, Da:	5.49
IP(EA), eV:	-9.45(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3-methyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]-3-(6-methylpyridin-2-yl)urea

Drug info:

PubChemData

Smile

CC1=NOC(C1)CNC(=O)NC2=CC(=NN2C)C3=CC(=CC(=C3)F)F

DOS

IR

Vibrations