Geometry & MOs

Info

ID:	32244
PubChem CID:	6436135
Reduced:	SN2O3C23H28 (1)
Stoich.:	AB2C3D23E28 (1)
Weight, g/mol:	287.298828
ΔH_f, kcal/mol:	-87.54
Dipole, Da:	4.15
IP(EA), eV:	-8.8(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-octadec-9-en-1-amine;hydrofluoride

Drug info:

PubChemData

Smile

CCC(CC)(CC(=O)NC1=CC=CC(=C1)/C=C/C2=NC(=CS2)C3CCC3)C(=O)O

DOS

IR

Vibrations