Geometry & MOs

Info

ID:	327067
PubChem CID:	126688953
Reduced:	O7C24H44 (1)
Stoich.:	A7B24C44 (1)
Weight, g/mol:	297.111341
ΔH_f, kcal/mol:	-395.21
Dipole, Da:	6.66
IP(EA), eV:	-10.84(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(Z)-(5-amino-2-oxo-1H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCC(=O)OC(C)(C(=O)O[C@@H](C)C(=O)O)O

DOS

IR

Vibrations