Geometry & MOs

Info

ID:	227336
PubChem CID:	87561332
Reduced:	NPSCl3O4H17C21 (1)
Stoich.:	ABCD3E4F17G21 (1)
Weight, g/mol:	224.035255
ΔH_f, kcal/mol:	-168.98
Dipole, Da:	2.96
IP(EA), eV:	-8.87(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-4-cyclobutyloxyfuro[3,2-d]pyrimidine

Drug info:

PubChemData

Smile

C=CN(C1=CC(=CC(=C1)Cl)Cl)C(=O)C(C2=CSC3=C2C=C(C=C3)Cl)P4(=O)OCCCO4

DOS

IR

Vibrations