Geometry & MOs

Info

ID:	225221
PubChem CID:	85747977
Reduced:	NO7H37C41 (1)
Stoich.:	AB7C37D41 (1)
Weight, g/mol:	336.076451
ΔH_f, kcal/mol:	-148.72
Dipole, Da:	1.83
IP(EA), eV:	-7.82(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[chloro-(3,4,5-trimethoxyphenyl)methyl]-1,3-benzodioxole

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N(C2=CC=C(C=C2)C=CC3=CC=CC=C3)C4=CC=C(C=C4)C=CC5=CC=CC=C5OC(=O)OCCOCCOC(=O)O

DOS

IR

Vibrations