Geometry & MOs

Info

ID:	200694
PubChem CID:	79429254
Reduced:	O2C13H22 (1)
Stoich.:	A2B13C22 (1)
Weight, g/mol:	260.141245
ΔH_f, kcal/mol:	-129.32
Dipole, Da:	4.9
IP(EA), eV:	-10.59(0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclohexyl-2,3-dihydrochromene-4-carboxylic acid

Drug info:

PubChemData

Smile

CCC1CCC(C1)(C2CCCC2)C(=O)O

DOS

IR

Vibrations