Geometry & MOs

Info

ID:	449645
PubChem CID:	135300281
Reduced:	FSO2N3H22C23 (1)
Stoich.:	ABC2D3E22F23 (1)
Weight, g/mol:	349.334465
ΔH_f, kcal/mol:	-1.36
Dipole, Da:	7.29
IP(EA), eV:	-8.45(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3,7-dimethylnon-8-enyl-[(4-ethenylcyclohexyl)methyl]amino]propan-2-ol

Drug info:

PubChemData

Smile

CCCCS(=O)C1=NN2C(=CC(=NC2=C1)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)F

DOS

IR

Vibrations