Geometry & MOs

Info

ID:	437242
PubChem CID:	135216886
Reduced:	NO3C25H45 (1)
Stoich.:	AB3C25D45 (1)
Weight, g/mol:	231.1987
ΔH_f, kcal/mol:	-134.05
Dipole, Da:	5.7
IP(EA), eV:	-9.29(0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(E)-5-ethyl-5,6-dimethylhept-3-en-3-yl]pyridine

Drug info:

PubChemData

Smile

C[C@@H]1C2(CC1(C2)C(=O)N3CC(C3)OC(C)(C)C)CCCCCCCOC(C)(C)C

DOS

IR

Vibrations