Geometry & MOs

Info

ID:

407340

PubChem CID:

135079887

Reduced:

ClO3C11H11 (1)

Stoich.:

AB3C11D11 (1)

Weight, g/mol:

311.152144

ΔHf, kcal/mol:

-103.13

Dipole, Da:

2.05

IP(EA), eV:

-9.48(-0.72)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

propan-2-yl 2-(4-methoxyphenyl)imino-2-(3-methylphenyl)acetate

Drug info:

PubChemData

Smile

COC(=O)C(/C=C/C1=CC=C(C=C1)Cl)O

DOS

IR

Vibrations