Geometry & MOs

Info

ID:	230091
PubChem CID:	87570119
Reduced:	NO4C6H9 (1)
Stoich.:	AB4C6D9 (1)
Weight, g/mol:	272.082874
ΔH_f, kcal/mol:	-173.09
Dipole, Da:	7.16
IP(EA), eV:	-9.58(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(6-chloro-1-methylpyrrolo[3,2-c]pyridin-2-yl)pyridin-3-yl]methanamine

Drug info:

PubChemData

Smile

C=C(CCC(=O)O)NC(=O)O

DOS

IR

Vibrations