Geometry & MOs

Info

ID:	310641
PubChem CID:	126584081
Reduced:	FSO3N4C23H27 (1)
Stoich.:	ABC3D4E23F27 (1)
Weight, g/mol:	113.120449
ΔH_f, kcal/mol:	-106.48
Dipole, Da:	6.58
IP(EA), eV:	-8.76(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-methylhex-3-en-3-amine

Drug info:

PubChemData

Smile

CN(C)CCCN1CCN(CC1=O)S(=O)(=O)C2=CC=C(C=C2)C3=CNC4=C3C=CC(=C4)F

DOS

IR

Vibrations