Geometry & MOs

Info

ID:	46130
PubChem CID:	10522281
Reduced:	ClN2O5C16H21 (1)
Stoich.:	AB2C5D16E21 (1)
Weight, g/mol:	356.129156
ΔH_f, kcal/mol:	-225.34
Dipole, Da:	3.57
IP(EA), eV:	-9.03(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-[(3-chlorophenyl)methyl]-2-ethyl-4-methoxyindol-3-yl]acetamide

Drug info:

PubChemData

Smile

CC(=O)NC1=C(C=C(C(=C1)OC)C(=O)NC2COC(OC2)(C)C)Cl

DOS

IR

Vibrations