Geometry & MOs

Info

ID:	73088
PubChem CID:	48416976
Reduced:	SO4N6C15H18 (1)
Stoich.:	AB4C6D15E18 (1)
Weight, g/mol:	202.049075
ΔH_f, kcal/mol:	-52.79
Dipole, Da:	6.06
IP(EA), eV:	-9.42(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-1-(furan-3-carbonyl)pyrazole-4-carbonitrile

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)S(=O)(=O)N2CCCC(C2)C(=O)N3C(=C(C=N3)C#N)N

DOS

IR

Vibrations