Geometry & MOs

Info

ID:	318907
PubChem CID:	126653698
Reduced:	SO2N3C17H19 (1)
Stoich.:	AB2C3D17E19 (1)
Weight, g/mol:	272.109568
ΔH_f, kcal/mol:	-19.33
Dipole, Da:	5.79
IP(EA), eV:	-8.65(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-tert-butyl-7-(1H-pyrazol-4-yl)thieno[3,2-c]pyridin-4-amine

Drug info:

PubChemData

Smile

CC(C)(C)S(=O)(=O)N(C1=CC=CC=C1)C2=CC3=C(N2)N=CC=C3

DOS

IR

Vibrations