Geometry & MOs

Info

ID:	201190
PubChem CID:	79503477
Reduced:	ON4C11H16 (1)
Stoich.:	AB4C11D16 (1)
Weight, g/mol:	226.033603
ΔH_f, kcal/mol:	5.07
Dipole, Da:	5.53
IP(EA), eV:	-9.61(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(aminomethyl)-1H-pyrazol-5-yl]-1,1-difluoromethanesulfonamide

Drug info:

PubChemData

Smile

CCC(C)(C)C(=O)NC1=C(C=NN1C)C#N

DOS

IR

Vibrations