Geometry & MOs

Info

ID:	293638
PubChem CID:	117394908
Reduced:	ClO4C12H13 (1)
Stoich.:	AB4C12D13 (1)
Weight, g/mol:	256.050237
ΔH_f, kcal/mol:	-146.81
Dipole, Da:	7.82
IP(EA), eV:	-8.99(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chloro-2,3-dimethoxyphenyl)cyclopropane-1-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1Cl)C2(CC2)C(=O)O)O)OC

DOS

IR

Vibrations