Geometry & MOs

Info

ID:	260656
PubChem CID:	103199168
Reduced:	INSF2O3H8C11 (1)
Stoich.:	ABCD2E3F8G11 (1)
Weight, g/mol:	299.108148
ΔH_f, kcal/mol:	-140.86
Dipole, Da:	4.79
IP(EA), eV:	-9.57(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-(difluoromethyl)-2-(3-ethyl-1-methylpyrazol-4-yl)-1,3-oxazole-5-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(N=C(O1)C2=CSC(=C2)I)C(F)F

DOS

IR

Vibrations