Geometry & MOs

Info

ID:

31939

PubChem CID:

3724267

Reduced:

NOC19H23 (1)

Stoich.:

ABC19D23 (1)

Weight, g/mol:

368.116092

ΔHf, kcal/mol:

-20.77

Dipole, Da:

3.58

IP(EA), eV:

-9.34(0.24)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-(4-nitrophenyl)-2,5-diphenylpyrrole-3-carbaldehyde

Drug info:

PubChemData

Smile

CCCCNC(=O)CC(C1=CC=CC=C1)C2=CC=CC=C2

DOS

IR

Vibrations