Geometry & MOs

Info

ID:	293101
PubChem CID:	117373988
Reduced:	O3C15H20 (1)
Stoich.:	A3B15C20 (1)
Weight, g/mol:	248.141244
ΔH_f, kcal/mol:	-146.89
Dipole, Da:	6.35
IP(EA), eV:	-9.01(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,2-dimethyl-3,4-dihydrochromen-6-yl)-2-methylpropanoic acid

Drug info:

PubChemData

Smile

CC(CC1=CC=CC2=C1OC(CC2)(C)C)C(=O)O

DOS

IR

Vibrations