Geometry & MOs

Info

ID:	356246
PubChem CID:	127291319
Reduced:	OSN2C9H14 (2)
Stoich.:	ABC2D9E14 (2)
Weight, g/mol:	380.134068
ΔH_f, kcal/mol:	-63.34
Dipole, Da:	6.83
IP(EA), eV:	-8.87(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclobutyl-[4-[4-(1,3-thiazol-4-ylmethyl)piperazine-1-carbonyl]-1,3-thiazolidin-3-yl]methanone

Drug info:

PubChemData

Smile

CC(C)(C)CC(=O)N1CSCC1C(=O)N2CCN(CC2)CC3=CSC=N3

DOS

IR

Vibrations