Geometry & MOs

Info

ID:	446376
PubChem CID:	135274539
Reduced:	O2C13H16 (1)
Stoich.:	A2B13C16 (1)
Weight, g/mol:	898.878923
ΔH_f, kcal/mol:	-67.68
Dipole, Da:	2.93
IP(EA), eV:	-9.7(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[2-[1,3-bis[2-[bis(3-methylbutyl)amino]ethoxy]propan-2-yloxy]-3-[2-[bis(3-methylbutyl)amino]ethoxy]propoxy]ethyl]-3-methyl-N-(3-methylbutyl)butan-1-amine

Drug info:

PubChemData

Smile

CCC1=CC2CC1C3(C2C(=O)CC3=O)C

DOS

IR

Vibrations