Geometry & MOs

Info

ID:	368165
PubChem CID:	127327716
Reduced:	SO2N3C13H23 (1)
Stoich.:	AB2C3D13E23 (1)
Weight, g/mol:	262.171499
ΔH_f, kcal/mol:	-70.5
Dipole, Da:	6.26
IP(EA), eV:	-9.26(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-tert-butyl-N,N-dimethylazepane-1-sulfonamide

Drug info:

PubChemData

Smile

CC(C)(C)C1CCN(CC1)S(=O)(=O)C2=CN(N=C2)C

DOS

IR

Vibrations