Geometry & MOs

Info

ID:	351900
PubChem CID:	127282818
Reduced:	OS2N3C9H13 (1)
Stoich.:	AB2C3D9E13 (1)
Weight, g/mol:	254.120132
ΔH_f, kcal/mol:	-7.94
Dipole, Da:	3.38
IP(EA), eV:	-8.95(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CN(CCS1)C(=O)NC2=NC=CS2

DOS

IR

Vibrations