Geometry & MOs

Info

ID:	256909
PubChem CID:	103142331
Reduced:	O3C16H28 (1)
Stoich.:	A3B16C28 (1)
Weight, g/mol:	274.156895
ΔH_f, kcal/mol:	-187.95
Dipole, Da:	6.83
IP(EA), eV:	-10.1(1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-methyloxolan-2-yl)methyl]-3,4-dihydro-1H-naphthalene-2-carboxylic acid

Drug info:

PubChemData

Smile

CC1CCC(O1)CC2(CCC(CC2)C(C)C)C(=O)O

DOS

IR

Vibrations