Geometry & MOs

Info

ID:	437803
PubChem CID:	135227089
Reduced:	ClFSO3N4H20C24 (1)
Stoich.:	ABCD3E4F20G24 (1)
Weight, g/mol:	370.07145
ΔH_f, kcal/mol:	-31.96
Dipole, Da:	4.71
IP(EA), eV:	-8.38(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-4-(cyclopropylsulfonimidoyl)-N-(4-methylcyclohexyl)aniline

Drug info:

PubChemData

Smile

CC(C)(C#N)S(=N)(=O)C1=CC(=C(C=C1)OC2=C(C=C(C=C2)Cl)F)C3=CN(C(=O)C4=C3C=CN4)C

DOS

IR

Vibrations