Geometry & MOs

Info

ID:	253379
PubChem CID:	103118035
Reduced:	OSN5C12H15 (1)
Stoich.:	ABC5D12E15 (1)
Weight, g/mol:	286.06368
ΔH_f, kcal/mol:	40.93
Dipole, Da:	7.42
IP(EA), eV:	-8.98(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-carbamothioyl-1H-pyrazol-5-yl)pyrazolo[1,5-a]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)N(CC(=S)N)C(=O)C1=C2C=NC=CN2N=C1

DOS

IR

Vibrations