Geometry & MOs

Info

ID:	294584
PubChem CID:	117472140
Reduced:	O4C17H24 (1)
Stoich.:	A4B17C24 (1)
Weight, g/mol:	292.167459
ΔH_f, kcal/mol:	-176.2
Dipole, Da:	6.62
IP(EA), eV:	-9.13(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-tert-butyl-2,5-dimethoxyphenyl)cyclobutane-1-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)C1=C(C(=C(C=C1)OC)O)C2(CCCCC2)C(=O)O

DOS

IR

Vibrations