Geometry & MOs

Info

ID:	162796
PubChem CID:	57570891
Reduced:	N2O3C11H18 (1)
Stoich.:	A2B3C11D18 (1)
Weight, g/mol:	461.19058
ΔH_f, kcal/mol:	-115.44
Dipole, Da:	4.43
IP(EA), eV:	-9.67(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[2-[2-[3,5-bis(hydroxymethyl)phenoxy]ethoxy]ethoxy]ethyl]-4-methyl-4-(methyldisulfanyl)pentanamide

Drug info:

PubChemData

Smile

C1=C(C=C(N=C1CO)CO)OCCCCN

DOS

IR

Vibrations