Geometry & MOs

Info

ID:	194624
PubChem CID:	78565069
Reduced:	N4O4H20C23 (1)
Stoich.:	A4B4C20D23 (1)
Weight, g/mol:	404.158351
ΔH_f, kcal/mol:	-15.24
Dipole, Da:	8.97
IP(EA), eV:	-9.6(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-[2-[3-(furan-2-carbonylamino)propanoyloxy]propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)C(=CC3=CC=CC=C3)N4C(=NN=N4)C)C

DOS

IR

Vibrations