Geometry & MOs

Info

ID:	294265
PubChem CID:	117446595
Reduced:	O3C17H26 (1)
Stoich.:	A3B17C26 (1)
Weight, g/mol:	278.199428
ΔH_f, kcal/mol:	-149.56
Dipole, Da:	5.73
IP(EA), eV:	-9.11(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(5-ethyl-2,4-dimethoxyphenyl)ethyl]piperazine

Drug info:

PubChemData

Smile

CCC1=CC(=C(C(=C1)C(C)(C)C)OC)CC(C)C(=O)O

DOS

IR

Vibrations