Geometry & MOs

Info

ID:	370902
PubChem CID:	127341231
Reduced:	O2N3C15H25 (1)
Stoich.:	A2B3C15D25 (1)
Weight, g/mol:	307.110296
ΔH_f, kcal/mol:	-68.57
Dipole, Da:	4.1
IP(EA), eV:	-9.38(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-ethyl-3-oxopiperazin-1-yl)methyl]-7-methyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one

Drug info:

PubChemData

Smile

CCC1C(=O)NCCN1CC(=O)NC(C2CC2)C3CC3

DOS

IR

Vibrations