Geometry & MOs

Info

ID:	363757
PubChem CID:	127313395
Reduced:	O2N5C19H25 (1)
Stoich.:	A2B5C19D25 (1)
Weight, g/mol:	323.141596
ΔH_f, kcal/mol:	-25.41
Dipole, Da:	7.31
IP(EA), eV:	-8.6(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC(C1)C(=O)N2CCN(CC2)CCNC(=O)C3=CN4C=CC=CC4=N3

DOS

IR

Vibrations