Geometry & MOs

Info

ID:	371675
PubChem CID:	131270306
Reduced:	NO2C9H15 (1)
Stoich.:	AB2C9D15 (1)
Weight, g/mol:	113.120449
ΔH_f, kcal/mol:	-47.64
Dipole, Da:	2.18
IP(EA), eV:	-9.48(1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-2-methylhex-4-en-2-amine

Drug info:

PubChemData

Smile

CC(C)(C#C)N[C@@H]1COC[C@H]1O

DOS

IR

Vibrations