Geometry & MOs

Info

ID:	360400
PubChem CID:	127301045
Reduced:	SO3N4C17H28 (1)
Stoich.:	AB3C4D17E28 (1)
Weight, g/mol:	366.205576
ΔH_f, kcal/mol:	-117.01
Dipole, Da:	0.99
IP(EA), eV:	-9.09(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[3-(4-methylpyrazol-1-yl)piperidin-1-yl]-2-oxoethyl]-2,3-dihydro-1H-indene-5-carboxamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)N1CCCC(C1)C(=O)N2CCCC(C2)N3C=C(C=N3)C

DOS

IR

Vibrations