Geometry & MOs

Info

ID:	367933
PubChem CID:	127326107
Reduced:	SO2N3C20H21 (1)
Stoich.:	AB2C3D20E21 (1)
Weight, g/mol:	370.182733
ΔH_f, kcal/mol:	-27.55
Dipole, Da:	1.6
IP(EA), eV:	-8.77(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-cyclopentylpyrazol-3-yl)-2-(3-phenylthiomorpholin-4-yl)acetamide

Drug info:

PubChemData

Smile

C1CSCC(N1CC(=O)N2CC(=O)NC3=CC=CC=C32)C4=CC=CC=C4

DOS

IR

Vibrations