Geometry & MOs

Info

ID:	369320
PubChem CID:	127332321
Reduced:	OS2N3C10H15 (1)
Stoich.:	AB2C3D10E15 (1)
Weight, g/mol:	268.135782
ΔH_f, kcal/mol:	-12.37
Dipole, Da:	4.35
IP(EA), eV:	-8.9(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-dimethylpyrazol-3-yl)-2,3-dimethylthiomorpholine-4-carboxamide

Drug info:

PubChemData

Smile

CC1C(SCCN1C(=O)NC2=NC=CS2)C

DOS

IR

Vibrations