Geometry & MOs

Info

ID:	360111
PubChem CID:	127300496
Reduced:	SN4O4C12H22 (1)
Stoich.:	AB4C4D12E22 (1)
Weight, g/mol:	332.188212
ΔH_f, kcal/mol:	-166.72
Dipole, Da:	5.46
IP(EA), eV:	-9.94(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclobutylmethylsulfamoyl)ethyl]-4-methyl-1,4-diazepane-1-carboxamide

Drug info:

PubChemData

Smile

C1CC(C1)CNS(=O)(=O)CCNC(=O)N2CCNC(=O)C2

DOS

IR

Vibrations