Geometry & MOs

Info

ID:	307501
PubChem CID:	125307153
Reduced:	NO2C11H12 (2)
Stoich.:	AB2C11D12 (2)
Weight, g/mol:	265.121512
ΔH_f, kcal/mol:	-70.61
Dipole, Da:	2.78
IP(EA), eV:	-8.82(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-pyridin-2-ylethyl)-2H-indole-3-carboxamide

Drug info:

PubChemData

Smile

COCC1=C(C=CC(=C1)[C@H]2[C@H]3C(=C4C=CC=CC4=N3)C[C@H](N2)C(=O)OC)OC

DOS

IR

Vibrations