Geometry & MOs

Info

ID:	227392
PubChem CID:	87561622
Reduced:	NSO3C5H5 (1)
Stoich.:	ABC3D5E5 (1)
Weight, g/mol:	223.05124
ΔH_f, kcal/mol:	-65.91
Dipole, Da:	6.39
IP(EA), eV:	-9.34(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-(1-methylcyclopropyl)furo[3,2-d]pyrimidin-4-amine

Drug info:

PubChemData

Smile

C1=CSC(=C1NO)C(=O)O

DOS

IR

Vibrations