Geometry & MOs

Info

ID:	156391
PubChem CID:	56370414
Reduced:	BrNSO3C17H26 (1)
Stoich.:	ABCD3E17F26 (1)
Weight, g/mol:	475.05653
ΔH_f, kcal/mol:	-134.2
Dipole, Da:	3.0
IP(EA), eV:	-9.49(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromophenyl)sulfonyl-N-[3-(3,5-dimethylpyrazol-1-yl)phenyl]-2-methylpropanamide

Drug info:

PubChemData

Smile

CC(C)CC(C)N(C)C(=O)C(C)(C)S(=O)(=O)C1=CC=C(C=C1)Br

DOS

IR

Vibrations