Geometry & MOs

Info

ID:

194099

PubChem CID:

78483267

Reduced:

OSCl2N2H16C17 (1)

Stoich.:

ABC2D2E16F17 (1)

Weight, g/mol:

379.177016

ΔHf, kcal/mol:

11.0

Dipole, Da:

6.06

IP(EA), eV:

-9.18(-0.95)

Spin(Sz, S2):

None, None

Charge, e:

1

Chem-info

IUPAC name:

4-methyl-N-[[1-(morpholin-4-ium-4-ylmethyl)-2-oxoindol-3-ylidene]amino]benzamide

Drug info:

PubChemData

Smile

CC1CCC2=C(C1)C=C(S2)C(=O)NN=CC3=C(C(=CC=C3)Cl)Cl

DOS

IR

Vibrations