Geometry & MOs

Info

ID:	147841
PubChem CID:	53787499
Reduced:	ON4C17H24 (1)
Stoich.:	AB4C17D24 (1)
Weight, g/mol:	195.089543
ΔH_f, kcal/mol:	12.81
Dipole, Da:	5.39
IP(EA), eV:	-8.09(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(propoxyamino)benzoic acid

Drug info:

PubChemData

Smile

CCCCCN1C=CC(=C1NC2=CN(C(=C2)O)CCC)C#N

DOS

IR

Vibrations