Geometry & MOs

Info

ID:	310672
PubChem CID:	126584228
Reduced:	FON3H18C19 (1)
Stoich.:	ABC3D18E19 (1)
Weight, g/mol:	125.120449
ΔH_f, kcal/mol:	-20.2
Dipole, Da:	4.13
IP(EA), eV:	-8.63(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2E,4Z)-6-methylhepta-2,4-dien-2-amine

Drug info:

PubChemData

Smile

C1CN(CCN1)C(=O)C2=CC=C(C=C2)C3=CNC4=C3C=CC(=C4)F

DOS

IR

Vibrations