Geometry & MOs

Info

ID:	40461
PubChem CID:	8144168
Reduced:	N3O3C23H27 (1)
Stoich.:	A3B3C23D27 (1)
Weight, g/mol:	386.108899
ΔH_f, kcal/mol:	-65.84
Dipole, Da:	5.2
IP(EA), eV:	-9.03(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

CCCCN(C)CN1C2=CC=CC=C2C(=NC3=CC=C(C=C3)C(=O)OCC)C1=O

DOS

IR

Vibrations