Geometry & MOs

Info

ID:	73395
PubChem CID:	48417609
Reduced:	SO3N5C15H15 (1)
Stoich.:	AB3C5D15E15 (1)
Weight, g/mol:	275.138225
ΔH_f, kcal/mol:	5.2
Dipole, Da:	5.28
IP(EA), eV:	-9.49(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-1-[1-(2-methylpropyl)-5-oxopyrrolidine-3-carbonyl]pyrazole-4-carbonitrile

Drug info:

PubChemData

Smile

C1CC1CNS(=O)(=O)C2=CC=CC(=C2)C(=O)N3C(=C(C=N3)C#N)N

DOS

IR

Vibrations