Geometry & MOs

Info

ID:	282249
PubChem CID:	103920121
Reduced:	SO2N3C7H11 (1)
Stoich.:	AB2C3D7E11 (1)
Weight, g/mol:	203.098
ΔH_f, kcal/mol:	-39.64
Dipole, Da:	5.59
IP(EA), eV:	-10.24(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-1-hydroxybutan-2-yl]thiolane-3-carboxamide

Drug info:

PubChemData

Smile

CC[C@H](CO)NC(=O)C1=CN=NS1

DOS

IR

Vibrations