Geometry & MOs

Info

ID:	282911
PubChem CID:	103945442
Reduced:	SN3O3C12H19 (1)
Stoich.:	AB3C3D12E19 (1)
Weight, g/mol:	215.152144
ΔH_f, kcal/mol:	-122.06
Dipole, Da:	6.89
IP(EA), eV:	-9.47(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-(1-hydroxy-3-methylpentan-3-yl)oxolane-2-carboxamide

Drug info:

PubChemData

Smile

CCC(C)(CCO)NC(=O)C1=CSC(=N1)NC(=O)C

DOS

IR

Vibrations