Geometry & MOs

Info

ID:	64959
PubChem CID:	29204253
Reduced:	ON4H16C17 (1)
Stoich.:	AB4C16D17 (1)
Weight, g/mol:	323.126991
ΔH_f, kcal/mol:	56.99
Dipole, Da:	5.27
IP(EA), eV:	-9.23(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-[2-oxo-2-(pyridin-3-ylmethylamino)ethyl]indole-3-carboxylate

Drug info:

PubChemData

Smile

CC1=CC=NN1C2=CC=C(C=C2)C(=O)NCC3=CN=CC=C3

DOS

IR

Vibrations