Geometry & MOs

Info

ID:	403742
PubChem CID:	135061645
Reduced:	O2N3C13H15 (1)
Stoich.:	A2B3C13D15 (1)
Weight, g/mol:	353.173942
ΔH_f, kcal/mol:	-30.65
Dipole, Da:	6.45
IP(EA), eV:	-9.43(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-diethyl-4-[hydroxy-(4-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C1=CNC2=NC=CC(=C12)C=O

DOS

IR

Vibrations