Geometry & MOs

Info

ID:	385085
PubChem CID:	134978287
Reduced:	O3C10H11 (2)
Stoich.:	A3B10C11 (2)
Weight, g/mol:	311.152144
ΔH_f, kcal/mol:	-208.32
Dipole, Da:	5.53
IP(EA), eV:	-10.11(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethoxy-4-[(E)-(1-ethyl-3,3-dimethylindol-2-ylidene)methyl]cyclobut-3-ene-1,2-dione

Drug info:

PubChemData

Smile

CC1(CC(=O)C(C(=O)C1)C2=C(C(=O)C2=O)C3C(=O)CC(CC3=O)(C)C)C

DOS

IR

Vibrations