Geometry & MOs

Info

ID:	236325
PubChem CID:	92712347
Reduced:	SO3N4C15H16 (1)
Stoich.:	AB3C4D15E16 (1)
Weight, g/mol:	332.094312
ΔH_f, kcal/mol:	-28.9
Dipole, Da:	6.51
IP(EA), eV:	-9.52(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-(3-methyl-4-oxo-[1,2]oxazolo[5,4-d]pyrimidin-5-yl)-N-(thiophen-2-ylmethyl)butanamide

Drug info:

PubChemData

Smile

CC[C@@H](C(=O)NCC1=CC=CS1)N2C=NC3=C(C2=O)C(=NO3)C

DOS

IR

Vibrations