Geometry & MOs

Info

ID:	73394
PubChem CID:	48417607
Reduced:	ON5H15C16 (1)
Stoich.:	AB5C15D16 (1)
Weight, g/mol:	345.089561
ΔH_f, kcal/mol:	50.99
Dipole, Da:	4.9
IP(EA), eV:	-8.52(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-amino-4-cyanopyrazole-1-carbonyl)-N-(cyclopropylmethyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)NC(=C2CC(=O)N3C(=C(C=N3)C#N)N)C

DOS

IR

Vibrations