Geometry & MOs

Info

ID:	69595
PubChem CID:	47204999
Reduced:	NSF2O2H11C13 (1)
Stoich.:	ABC2D2E11F13 (1)
Weight, g/mol:	268.096026
ΔH_f, kcal/mol:	-127.57
Dipole, Da:	3.96
IP(EA), eV:	-9.62(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-(3-pyrazol-1-ylphenyl)-1,2-oxazole-5-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=O)NCC2=COC=C2)SC(F)F

DOS

IR

Vibrations