Geometry & MOs

Info

ID:	319293
PubChem CID:	126655545
Reduced:	O2N3C9H15 (1)
Stoich.:	A2B3C9D15 (1)
Weight, g/mol:	356.184841
ΔH_f, kcal/mol:	-56.67
Dipole, Da:	4.67
IP(EA), eV:	-8.75(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 1-benzyl-6-carbamoyl-6,7-dihydro-5H-pyrazolo[4,3-b]pyridine-4-carboxylate

Drug info:

PubChemData

Smile

C1C[C@H]([C@H](CN(C1)C2=CC=NN2)O)O

DOS

IR

Vibrations