Geometry & MOs

Info

ID:	264986
PubChem CID:	103506162
Reduced:	SN5C14H17 (1)
Stoich.:	AB5C14D17 (1)
Weight, g/mol:	279.115381
ΔH_f, kcal/mol:	97.9
Dipole, Da:	8.6
IP(EA), eV:	-8.25(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-5-[(1,3-dimethylpyrazol-4-yl)methylamino]-N-methylthiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NN(C=C1CNC2=C(C(=C(S2)C#N)N)C3CC3)C

DOS

IR

Vibrations