Geometry & MOs

Info

ID:	13641
PubChem CID:	396470
Reduced:	NO3H11C14 (1)
Stoich.:	AB3C11D14 (1)
Weight, g/mol:	241.073893
ΔH_f, kcal/mol:	-17.19
Dipole, Da:	3.75
IP(EA), eV:	-8.54(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[5-(furan-2-yl)-1-methylpyrrol-2-yl]furan-2-carbaldehyde

Drug info:

PubChemData

Smile

CN1C(=CC=C1C2=CC=C(O2)C=O)C3=CC=CO3

DOS

IR

Vibrations