Geometry & MOs

Info

ID:	205536
PubChem CID:	80117967
Reduced:	ON2C12H24 (1)
Stoich.:	AB2C12D24 (1)
Weight, g/mol:	288.127406
ΔH_f, kcal/mol:	-39.85
Dipole, Da:	4.13
IP(EA), eV:	-8.69(2.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-amino-5-(4-fluoro-2-methylanilino)-3-methylbenzoate

Drug info:

PubChemData

Smile

CCCN1CCCC(CC1)NC2COC2

DOS

IR

Vibrations