Geometry & MOs

Info

ID:	436228
PubChem CID:	135195558
Reduced:	N3C11H17 (1)
Stoich.:	A3B11C17 (1)
Weight, g/mol:	190.146999
ΔH_f, kcal/mol:	59.32
Dipole, Da:	4.49
IP(EA), eV:	-8.61(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,6-dimethyl-1-propan-2-yl-3a,7a-dihydropyrrolo[2,3-b]pyridine

Drug info:

PubChemData

Smile

CC1=CC2C=NN(C2N=C1C)C(C)C

DOS

IR

Vibrations