Geometry & MOs

Info

ID:	222637
PubChem CID:	85305665
Reduced:	NO6H11C22 (1)
Stoich.:	AB6C11D22 (1)
Weight, g/mol:	385.152537
ΔH_f, kcal/mol:	-32.88
Dipole, Da:	2.36
IP(EA), eV:	-9.44(-2.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,6,7-trimethoxy-2-(6-methoxy-1,3-benzodioxol-5-yl)-3,4-dihydro-2H-naphthalen-1-imine

Drug info:

PubChemData

Smile

CC1=CC2C(=C3C1=NC(=O)C4=C3OC(=O)C5=C4C6=CC=CC=C6O5)C=CC(=O)O2

DOS

IR

Vibrations