Geometry & MOs

Info

ID:	205602
PubChem CID:	80124867
Reduced:	SN2O2C12H18 (1)
Stoich.:	AB2C2D12E18 (1)
Weight, g/mol:	350.98188
ΔH_f, kcal/mol:	-47.61
Dipole, Da:	2.26
IP(EA), eV:	-8.78(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-2,6-difluoro-N-(1H-indazol-4-yl)benzamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)CSCCC(=O)ONN)C

DOS

IR

Vibrations