Geometry & MOs

Info

ID:

445346

PubChem CID:

135266308

Reduced:

ClOS2N6C49H63 (1)

Stoich.:

ABC2D6E49F63 (1)

Weight, g/mol:

332.225249

ΔHf, kcal/mol:

15.03

Dipole, Da:

5.52

IP(EA), eV:

 -7.91(-0.45)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-methyl-1-[(3Z,5E)-5-(3-methylphenyl)-4-(4-methylphenyl)octa-3,5,7-trien-3-yl]hydrazine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)SNC2=CC=C(C=C2)N3CCN(CC3)C4=CC=CC(=C4)C5=C(N(C(=C5C)C)C(C)C)C6=CC=C(C=C6)Cl)NC(CS)C(C)(C)CN7CCC(CC7)O

DOS

IR

Vibrations