Geometry & MOs

Info

ID:	395679
PubChem CID:	135026256
Reduced:	NO3C18H21 (1)
Stoich.:	AB3C18D21 (1)
Weight, g/mol:	365.089937
ΔH_f, kcal/mol:	-93.9
Dipole, Da:	6.58
IP(EA), eV:	-8.61(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 6-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]-1,3-dioxoisoindole-4-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)/C=C/C1=CN(CCC1=O)C2=CC=CC=C2

DOS

IR

Vibrations