Geometry & MOs

Info

ID:	433154
PubChem CID:	135173291
Reduced:	SN2O5C20H24 (1)
Stoich.:	AB2C5D20E24 (1)
Weight, g/mol:	203.1674
ΔH_f, kcal/mol:	-138.85
Dipole, Da:	9.65
IP(EA), eV:	-8.62(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-1-phenyloct-1-en-2-amine

Drug info:

PubChemData

Smile

C1CC(C[C@@H]1NS(=O)O)COC2=COC(=CC2=O)CN3CC4=CC=CC=C4C3

DOS

IR

Vibrations