Geometry & MOs

Info

ID:	129306
PubChem CID:	51072224
Reduced:	N2O2C7H10 (1)
Stoich.:	A2B2C7D10 (1)
Weight, g/mol:	165.090212
ΔH_f, kcal/mol:	-83.18
Dipole, Da:	2.41
IP(EA), eV:	-9.86(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dimethyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-one

Drug info:

PubChemData

Smile

CN1C(=O)[C@@H]2CNC[C@@H]2C1=O

DOS

IR

Vibrations