Geometry & MOs

Info

ID:	30769
PubChem CID:	841832
Reduced:	ClOSN2H11C12 (1)
Stoich.:	ABCD2E11F12 (1)
Weight, g/mol:	291.0707
ΔH_f, kcal/mol:	5.23
Dipole, Da:	1.46
IP(EA), eV:	-9.17(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzodioxol-5-ylmethyl)-2,6-difluorobenzamide

Drug info:

PubChemData

Smile

C[C@H]1C[C@@H]1C(=O)NC2=NC3=C(S2)C=C(C=C3)Cl

DOS

IR

Vibrations