Geometry & MOs

Info

ID:	159143
PubChem CID:	57260893
Reduced:	N2F3O6H25C28 (1)
Stoich.:	A2B3C6D25E28 (1)
Weight, g/mol:	306.148061
ΔH_f, kcal/mol:	-291.87
Dipole, Da:	4.22
IP(EA), eV:	-9.29(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

spiro[adamantane-2,2'-pyrano[3,2-g]pteridine]

Drug info:

PubChemData

Smile

C1CN(CCC1OC(=O)C(=O)ON(C2=CC=CC=C2C3=CC=CC=C3)C(=O)O)CC4=CC(=CC=C4)C(F)(F)F

DOS

IR

Vibrations