Geometry & MOs

Info

ID:	372704
PubChem CID:	131302901
Reduced:	NO4C11H11 (1)
Stoich.:	AB4C11D11 (1)
Weight, g/mol:	225.093583
ΔH_f, kcal/mol:	-101.01
Dipole, Da:	2.73
IP(EA), eV:	-8.74(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-1-methyl-2-propan-2-yl-2,4-dihydrothieno[3,4-b]pyrazin-3-one

Drug info:

PubChemData

Smile

C1C(ONC1=C2C=CC=CC2=O)CC(=O)O

DOS

IR

Vibrations