Geometry & MOs

Info

ID:	133627
PubChem CID:	51564889
Reduced:	SO2N3C9H12 (2)
Stoich.:	AB2C3D9E12 (2)
Weight, g/mol:	342.091238
ΔH_f, kcal/mol:	-140.41
Dipole, Da:	3.95
IP(EA), eV:	-8.78(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

7-oxo-6-[[(2R)-4-phenylbutan-2-yl]carbamoyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-olate

Drug info:

PubChemData

Smile

CC1=CN2C(S1)NCC(C2=O)C(=O)NCCNC(=O)C3CNC4N(C3=O)C=C(S4)C

DOS

IR

Vibrations