Geometry & MOs

Info

ID:

13670

PubChem CID:

396836

Reduced:

SO2N4H34C46 (1)

Stoich.:

AB2C4D34E46 (1)

Weight, g/mol:

706.240248

ΔHf, kcal/mol:

141.36

Dipole, Da:

6.31

IP(EA), eV:

 -8.4(-1.24)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[4-[[3-[3-(4-acetamidophenyl)imino-2-phenylinden-1-yl]sulfanyl-2-phenylinden-1-ylidene]amino]phenyl]acetamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=C(C=C1)N=C2C3=CC=CC=C3C(=C2C4=CC=CC=C4)SC5=C(C(=NC6=CC=C(C=C6)NC(=O)C)C7=CC=CC=C75)C8=CC=CC=C8

DOS

IR

Vibrations