Geometry & MOs

Info

ID:	26351
PubChem CID:	645277
Reduced:	N4O4C23H28 (1)
Stoich.:	A4B4C23D28 (1)
Weight, g/mol:	194.051384
ΔH_f, kcal/mol:	-83.01
Dipole, Da:	5.06
IP(EA), eV:	-8.03(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,6-dimethyl-2-methylsulfanylfuro[2,3-d]pyrimidine

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC2=C(N1CC(=O)N3CCN(CC3)C4=CC=CC=C4OC)C=CN2C

DOS

IR

Vibrations