Geometry & MOs

Info

ID:

435503

PubChem CID:

135191644

Reduced:

N2O2H11C12 (2)

Stoich.:

A2B2C11D12 (2)

Weight, g/mol:

407.22968

ΔHf, kcal/mol:

-43.71

Dipole, Da:

5.12

IP(EA), eV:

 -8.91(-1.1)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-[(E)-[3-ethenyl-4-[2-ethyl-2-[(2,2,2-trifluoroethylamino)methyl]hydrazinyl]-2-methylidenecyclopent-3-en-1-ylidene]methyl]-3-[(Z)-prop-1-enyl]-1H-pyrrol-2-amine

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(O/C(=C\C2=CNC3=C2C=CC=N3)/C1=O)NC4=C(C=C(C=C4)CC=N)C

DOS

IR

Vibrations