Geometry & MOs

Info

ID:	372037
PubChem CID:	131288387
Reduced:	N2Cl4H8C9 (1)
Stoich.:	A2B4C8D9 (1)
Weight, g/mol:	186.032837
ΔH_f, kcal/mol:	24.35
Dipole, Da:	2.23
IP(EA), eV:	-9.7(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-fluoro-2,4-dihydroxybenzoate

Drug info:

PubChemData

Smile

C1CC1[C@@H](C2=NC(=C(C(=C2Cl)Cl)Cl)Cl)N

DOS

IR

Vibrations