Geometry & MOs

Info

ID:	363750
PubChem CID:	127313388
Reduced:	SO3N5C18H25 (1)
Stoich.:	AB3C5D18E25 (1)
Weight, g/mol:	351.172896
ΔH_f, kcal/mol:	-94.81
Dipole, Da:	9.75
IP(EA), eV:	-8.6(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-4-ethylthiadiazole-5-carboxamide

Drug info:

PubChemData

Smile

C1CC(C1)C(=O)N2CCN(CC2)CCNC(=O)C3=CN=C4N(C3=O)CCS4

DOS

IR

Vibrations