Geometry & MOs

Info

ID:	389859
PubChem CID:	134995622
Reduced:	IO3C10H13 (1)
Stoich.:	AB3C10D13 (1)
Weight, g/mol:	154.146999
ΔH_f, kcal/mol:	-46.81
Dipole, Da:	2.21
IP(EA), eV:	-9.15(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-1,3,5,6,7,8-hexahydropyrazolo[1,2-a]pyridazine

Drug info:

PubChemData

Smile

CO[C@H]([C@@H](CI)C1=CC=CC=C1)OO

DOS

IR

Vibrations