Geometry & MOs

Info

ID:	378646
PubChem CID:	134224740
Reduced:	ON6C25H40 (1)
Stoich.:	AB6C25D40 (1)
Weight, g/mol:	289.091869
ΔH_f, kcal/mol:	-22.74
Dipole, Da:	3.28
IP(EA), eV:	-8.73(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-methylpropylsulfonyl)-3-methylsulfanyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine

Drug info:

PubChemData

Smile

CCC(=O)N1CCC2=C(C1)NN=C2C(C)CCC(C)(C)N3CCC4=C(C3)NN=C4C(C)C

DOS

IR

Vibrations