Geometry & MOs

Info

ID:	155300
PubChem CID:	56352886
Reduced:	SN4O6C23H28 (1)
Stoich.:	AB4C6D23E28 (1)
Weight, g/mol:	381.14887
ΔH_f, kcal/mol:	-233.37
Dipole, Da:	7.41
IP(EA), eV:	-9.45(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)propan-2-yl]-1-(3-fluorophenyl)pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCCNS(=O)(=O)C1=CC=CC(=C1)NC(=O)C2CC(=O)NC3=CC=CC=C23

DOS

IR

Vibrations