Geometry & MOs

Info

ID:	144896
PubChem CID:	53429600
Reduced:	SN2O3C13H18 (1)
Stoich.:	AB2C3D13E18 (1)
Weight, g/mol:	242.037754
ΔH_f, kcal/mol:	-87.68
Dipole, Da:	5.82
IP(EA), eV:	-9.06(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-pyridin-4-ylaniline;dihydrochloride

Drug info:

PubChemData

Smile

CN1CCN(CC1)C2=C(C=C(C=C2)C=O)S(=O)(=O)C

DOS

IR

Vibrations