Geometry & MOs

Info

ID:	136348
PubChem CID:	52026896
Reduced:	N2O3C19H20 (1)
Stoich.:	A2B3C19D20 (1)
Weight, g/mol:	358.04292
ΔH_f, kcal/mol:	-69.05
Dipole, Da:	6.91
IP(EA), eV:	-7.94(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-N-[2-(4-bromoindol-1-yl)ethyl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=CC2=C1C=CN2CCNC(=O)CC3=CC=C(C=C3)O

DOS

IR

Vibrations