Geometry & MOs

Info

ID:	326509
PubChem CID:	126687694
Reduced:	N2O2C17H20 (1)
Stoich.:	A2B2C17D20 (1)
Weight, g/mol:	562.365825
ΔH_f, kcal/mol:	-56.25
Dipole, Da:	5.77
IP(EA), eV:	-9.55(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(3,5-diethyl-4-propan-2-ylphenyl)propan-2-yl]-1,3-dimethoxy-4-[2-(3,4,5-trimethoxyphenyl)propyl]benzene

Drug info:

PubChemData

Smile

CCC1=CC(=NC=C1)C2=NC(=C(C=C2)CC(=O)O)C(C)C

DOS

IR

Vibrations