Geometry & MOs

Info

ID:	413679
PubChem CID:	135086628
Reduced:	N2O2C17H24 (1)
Stoich.:	A2B2C17D24 (1)
Weight, g/mol:	271.120843
ΔH_f, kcal/mol:	-49.48
Dipole, Da:	7.6
IP(EA), eV:	-8.0(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (Z)-2-(3-formyl-1H-indol-2-yl)hex-2-enoate

Drug info:

PubChemData

Smile

CCOC(CN/C=C/1\C=NC2=C(C=CC(=C12)C)C)OCC

DOS

IR

Vibrations