Geometry & MOs

Info

ID:	312186
PubChem CID:	126603495
Reduced:	O5C28H34 (1)
Stoich.:	A5B28C34 (1)
Weight, g/mol:	171.1987
ΔH_f, kcal/mol:	-150.37
Dipole, Da:	1.35
IP(EA), eV:	-8.17(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-N,N-dimethylheptan-1-amine

Drug info:

PubChemData

Smile

CC(=C)[C@H]1CC2=C(O1)C=CC3=C2O[C@@H]4COC5=CC(=C(C=C5[C@@H]4C3(C)C(C)(C)C)OC)OC

DOS

IR

Vibrations