Geometry & MOs

Info

ID:	197536
PubChem CID:	78975159
Reduced:	ON4C13H20 (1)
Stoich.:	AB4C13D20 (1)
Weight, g/mol:	276.055322
ΔH_f, kcal/mol:	-19.78
Dipole, Da:	7.19
IP(EA), eV:	-8.71(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-6-[(4-methylphenyl)methoxy]benzoic acid

Drug info:

PubChemData

Smile

CC1=C(C=NN1)C(=O)NC2CCN3CCCC3C2

DOS

IR

Vibrations