Geometry & MOs

Info

ID:	446223
PubChem CID:	135273248
Reduced:	N4O6C25H34 (1)
Stoich.:	A4B6C25D34 (1)
Weight, g/mol:	434.12453
ΔH_f, kcal/mol:	-257.08
Dipole, Da:	8.91
IP(EA), eV:	-8.84(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2R)-1-[4-(3-bromopropoxy)phenyl]-6-methyl-2-phenyl-1,2,3,4-tetrahydronaphthalene

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC3=C(C=C2)C(=O)N(CC3=C)C(CCC(=O)N)C(=O)OC

DOS

IR

Vibrations