Geometry & MOs

Info

ID:	407313
PubChem CID:	135079780
Reduced:	NO3C21H25 (1)
Stoich.:	AB3C21D25 (1)
Weight, g/mol:	286.084124
ΔH_f, kcal/mol:	-102.1
Dipole, Da:	4.57
IP(EA), eV:	-8.85(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(3,5-dimethoxyphenyl)-1,3-benzodioxole-5-carbaldehyde

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)C(CC1=CC=CC=C1)C(=O)N(C)C2=CC=CC=C2

DOS

IR

Vibrations