Geometry & MOs

Info

ID:	312892
PubChem CID:	126609555
Reduced:	O2N3H23C25 (1)
Stoich.:	A2B3C23D25 (1)
Weight, g/mol:	442.189257
ΔH_f, kcal/mol:	36.04
Dipole, Da:	7.51
IP(EA), eV:	-8.07(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[2-[5-(2-hydroxyethoxy)-1-phenylindol-3-yl]-2-iminoethyl]-3-methylphenyl] acetate

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C/C(=N\OC(=O)C)/C2=CN(C3=CC=CC=C32)C4=CC=C(C=C4)N

DOS

IR

Vibrations