Geometry & MOs

Info

ID:	371573
PubChem CID:	127347202
Reduced:	ClSN2O2C9H11 (1)
Stoich.:	ABC2D2E9F11 (1)
Weight, g/mol:	271.135448
ΔH_f, kcal/mol:	-61.93
Dipole, Da:	1.99
IP(EA), eV:	-9.53(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-1-(1-methylimidazol-4-yl)sulfonylazepane

Drug info:

PubChemData

Smile

C1CN(CC2=C1C(=CC=C2)Cl)S(=O)(=O)N

DOS

IR

Vibrations