Geometry & MOs

Info

ID:	209416
PubChem CID:	80669637
Reduced:	BrNSO2C15H22 (1)
Stoich.:	ABCD2E15F22 (1)
Weight, g/mol:	286.03506
ΔH_f, kcal/mol:	-85.8
Dipole, Da:	5.12
IP(EA), eV:	-9.49(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromoethyl)-N-(dimethylsulfamoyl)butan-1-amine

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)S(=O)(=O)N(CCBr)C2CCCCC2

DOS

IR

Vibrations