Geometry & MOs

Info

ID:	159191
PubChem CID:	57264355
Reduced:	O4C17H28 (1)
Stoich.:	A4B17C28 (1)
Weight, g/mol:	411.444015
ΔH_f, kcal/mol:	-202.18
Dipole, Da:	1.55
IP(EA), eV:	-10.46(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-dodecan-3-yl-3-ethyl-2-(methylamino)dodecan-1-ol

Drug info:

PubChemData

Smile

CCCCOC(=O)C=C[C@H]1[C@H](C1(C)C)C(=O)OC(C)(C)C

DOS

IR

Vibrations