Geometry & MOs

Info

ID:	365856
PubChem CID:	127318812
Reduced:	ON4C21H30 (1)
Stoich.:	AB4C21D30 (1)
Weight, g/mol:	340.226312
ΔH_f, kcal/mol:	-17.89
Dipole, Da:	6.18
IP(EA), eV:	-8.78(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[(2-methylpiperidin-1-yl)methyl]piperidin-1-yl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone

Drug info:

PubChemData

Smile

CC1CCCCN1CC2CCCN(C2)C(=O)C3=CC(=CC4=C3NN=C4)C

DOS

IR

Vibrations