Geometry & MOs

Info

ID:	294410
PubChem CID:	117459550
Reduced:	NF2O2C15H21 (1)
Stoich.:	AB2C2D15E21 (1)
Weight, g/mol:	285.136493
ΔH_f, kcal/mol:	-157.2
Dipole, Da:	4.21
IP(EA), eV:	-9.16(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2-(4-methylcyclohexyl)phenyl]-1,2-oxazole-3-carboxylic acid

Drug info:

PubChemData

Smile

COC1=C(C=C(C(=C1OC)C2(CCCCC2)CN)F)F

DOS

IR

Vibrations