Geometry & MOs

Info

ID:	189396
PubChem CID:	77849474
Reduced:	O3N4C20H32 (1)
Stoich.:	A3B4C20D32 (1)
Weight, g/mol:	328.109293
ΔH_f, kcal/mol:	-120.66
Dipole, Da:	2.9
IP(EA), eV:	-8.58(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxy-1-[1-[(5-methylfuran-2-yl)methyl]-6,6-dioxo-2,3,4a,5,7,7a-hexahydrothieno[3,4-b]pyrazin-4-yl]ethanone

Drug info:

PubChemData

Smile

CCN(CCO)CC1CN(CC1CO)C2=C(C=CC=N2)C(=O)N3CCCC3

DOS

IR

Vibrations