Geometry & MOs

Info

ID:	392777
PubChem CID:	135017921
Reduced:	N2O6C17H26 (1)
Stoich.:	A2B6C17D26 (1)
Weight, g/mol:	388.072907
ΔH_f, kcal/mol:	-255.9
Dipole, Da:	4.1
IP(EA), eV:	-10.01(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-methoxy-3-methyl-1-(4-nitrophenyl)sulfonylindol-4-yl]acetaldehyde

Drug info:

PubChemData

Smile

CCOC(=O)C1=COC(=N1)C(=O)CC(C(C)C)NC(=O)OC(C)(C)C

DOS

IR

Vibrations