Geometry & MOs

Info

ID:	363872
PubChem CID:	127313529
Reduced:	SO2N4C19H30 (1)
Stoich.:	AB2C4D19E30 (1)
Weight, g/mol:	319.200825
ΔH_f, kcal/mol:	-72.43
Dipole, Da:	8.57
IP(EA), eV:	-8.74(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-2-methylpyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=NC=C(S1)C(=O)NCCN2CCN(CC2)C(=O)C3CCC3

DOS

IR

Vibrations