Geometry & MOs

Info

ID:	413765
PubChem CID:	135086715
Reduced:	NO5H23C27 (1)
Stoich.:	AB5C23D27 (1)
Weight, g/mol:	295.084458
ΔH_f, kcal/mol:	-88.25
Dipole, Da:	4.59
IP(EA), eV:	-8.38(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)/C=C(/C2=C(C3=CC=CC=C3N2)C=O)\C(=O)OC)OCC4=CC=CC=C4

DOS

IR

Vibrations