Geometry & MOs

Info

ID:	48555
PubChem CID:	11108183
Reduced:	NC18H33 (1)
Stoich.:	AB18C33 (1)
Weight, g/mol:	265.131408
ΔH_f, kcal/mol:	-29.04
Dipole, Da:	0.98
IP(EA), eV:	-8.4(0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(5,6-dimethoxy-2-methyl-1,3-dihydroisoindol-1-yl)acetate

Drug info:

PubChemData

Smile

CC(C)C1=CC(=C(C1CCN(C)C)C(C)C)C(C)C

DOS

IR

Vibrations