Geometry & MOs

Info

ID:	79774
PubChem CID:	49830312
Reduced:	ClON7C21H26 (1)
Stoich.:	ABC7D21E26 (1)
Weight, g/mol:	348.114174
ΔH_f, kcal/mol:	19.87
Dipole, Da:	2.65
IP(EA), eV:	-9.03(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-6-chloro-N-methyl-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyridin-2-amine

Drug info:

PubChemData

Smile

CN(C)CC(=O)NC1CCC(CC1)NC2=NC(=CC(=N2)Cl)C3=CNC4=C3C=CC=N4

DOS

IR

Vibrations