Geometry & MOs

Info

ID:	30182
PubChem CID:	840511
Reduced:	ON3C19H23 (1)
Stoich.:	AB3C19D23 (1)
Weight, g/mol:	345.111341
ΔH_f, kcal/mol:	43.98
Dipole, Da:	2.1
IP(EA), eV:	-8.1(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[phenyl(pyridin-4-yl)methylidene]amino]-1,3-benzodioxole-5-carboxamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)N=CC2=CC=C(C=C2)OCC3=CC=CC=C3

DOS

IR

Vibrations