Geometry & MOs

Info

ID:	360110
PubChem CID:	127300495
Reduced:	S2N4O5C14H28 (1)
Stoich.:	A2B4C5D14E28 (1)
Weight, g/mol:	318.136176
ΔH_f, kcal/mol:	-216.83
Dipole, Da:	2.47
IP(EA), eV:	-9.12(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclobutylmethylsulfamoyl)ethyl]-3-oxopiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)N1CCN(CC1)C(=O)NCCS(=O)(=O)NCC2CCC2

DOS

IR

Vibrations