Geometry & MOs

Info

ID:	26358
PubChem CID:	645324
Reduced:	FN3O3C22H24 (1)
Stoich.:	AB3C3D22E24 (1)
Weight, g/mol:	242.080376
ΔH_f, kcal/mol:	-112.7
Dipole, Da:	5.39
IP(EA), eV:	-9.03(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-4-(furan-3-yl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Drug info:

PubChemData

Smile

CC1=NC2=C(N1C3CCN(CC3)C(=O)C4=CC(=CC(=C4)OC)OC)C=CC(=C2)F

DOS

IR

Vibrations