Geometry & MOs

Info

ID:	383274
PubChem CID:	134974902
Reduced:	N2O2C27H38 (1)
Stoich.:	A2B2C27D38 (1)
Weight, g/mol:	348.281701
ΔH_f, kcal/mol:	-48.98
Dipole, Da:	2.51
IP(EA), eV:	-8.62(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3,5-trimethyl-2-[(Z)-5-(2,4,6-trimethylphenyl)oct-4-en-4-yl]benzene

Drug info:

PubChemData

Smile

C1[C@H]2CN(CC1CN(C2)C[C@@H](C3=CC=CC=C3)O)CCCCCOCC4=CC=CC=C4

DOS

IR

Vibrations