Geometry & MOs

Info

ID:	363781
PubChem CID:	127313421
Reduced:	ON2C11H14 (2)
Stoich.:	AB2C11D14 (2)
Weight, g/mol:	336.161997
ΔH_f, kcal/mol:	-37.94
Dipole, Da:	5.76
IP(EA), eV:	-9.1(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-2-methyl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=NC2=CC=CC=C2C(=C1)C(=O)NCCN3CCN(CC3)C(=O)C4CCC4

DOS

IR

Vibrations