Geometry & MOs

Info

ID:	30655
PubChem CID:	841626
Reduced:	SO2N3C17H17 (1)
Stoich.:	AB2C3D17E17 (1)
Weight, g/mol:	245.068808
ΔH_f, kcal/mol:	-3.53
Dipole, Da:	3.08
IP(EA), eV:	-8.58(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzodioxol-5-yl)-5-methylfuran-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC2=C1C(=O)N(C(=N2)C)N=CC3=CC=C(C=C3)OC)C

DOS

IR

Vibrations