Geometry & MOs

Info

ID:	201162
PubChem CID:	79498579
Reduced:	N3C11H23 (1)
Stoich.:	A3B11C23 (1)
Weight, g/mol:	317.098017
ΔH_f, kcal/mol:	-19.0
Dipole, Da:	2.74
IP(EA), eV:	-8.76(1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-5-[(4-methylpiperidin-1-yl)sulfonylamino]pyrazole-4-carbothioamide

Drug info:

PubChemData

Smile

CC(C)CN1C(CN=C1N)C(C)(C)C

DOS

IR

Vibrations