Geometry & MOs

Info

ID:	360254
PubChem CID:	127300897
Reduced:	O2N5C22H33 (1)
Stoich.:	A2B5C22D33 (1)
Weight, g/mol:	368.159689
ΔH_f, kcal/mol:	-89.44
Dipole, Da:	7.92
IP(EA), eV:	-9.57(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-oxo-2-(3-propan-2-yl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)ethyl]quinazoline-2,4-dione

Drug info:

PubChemData

Smile

CC(C)C1=NN=C2N1CCN(C2)C(=O)CNC(=O)CC34CC5CC(C3)CC(C5)C4

DOS

IR

Vibrations