Geometry & MOs

Info

ID:	260648
PubChem CID:	103198778
Reduced:	SO2N5C13H21 (1)
Stoich.:	AB2C5D13E21 (1)
Weight, g/mol:	259.102
ΔH_f, kcal/mol:	-64.87
Dipole, Da:	2.78
IP(EA), eV:	-8.04(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclohexylmethyl)-4-(difluoromethyl)-1,3-oxazole-5-carboxylic acid

Drug info:

PubChemData

Smile

CNC(=O)C1CCCN(C1)C(=O)C2=C(N=C(S2)N(C)C)N

DOS

IR

Vibrations