Geometry & MOs

Info

ID:	324448
PubChem CID:	126677688
Reduced:	FO4N6H21C23 (1)
Stoich.:	AB4C6D21E23 (1)
Weight, g/mol:	169.18305
ΔH_f, kcal/mol:	-64.42
Dipole, Da:	5.39
IP(EA), eV:	-8.61(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-4,7-dimethylnon-5-en-3-amine

Drug info:

PubChemData

Smile

C1COC[C@@H](COCN1C2=NN(C=C2)C3=CC(=NC4=C3C(=O)NC4)C5=C(C=CC=C5F)C#N)O

DOS

IR

Vibrations