Geometry & MOs

Info

ID:	414223
PubChem CID:	135087179
Reduced:	N2O3C14H16 (1)
Stoich.:	A2B3C14D16 (1)
Weight, g/mol:	344.188863
ΔH_f, kcal/mol:	-5.75
Dipole, Da:	3.13
IP(EA), eV:	-8.71(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-1-[1-(methoxymethyl)-3-(2-phenylethynyl)indol-2-yl]methanimine

Drug info:

PubChemData

Smile

COCOC/C=C/C\1=C2C=CC=CC2=N/C1=C/NO

DOS

IR

Vibrations