Geometry & MOs

Info

ID:	312899
PubChem CID:	126609605
Reduced:	N2O3H22C24 (1)
Stoich.:	A2B3C22D24 (1)
Weight, g/mol:	483.50153
ΔH_f, kcal/mol:	7.66
Dipole, Da:	4.22
IP(EA), eV:	-8.36(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N,N-dimethyl-1-octadecoxy-3-octoxypropan-2-amine

Drug info:

PubChemData

Smile

CCC(=O)O/N=C(\CC1=CC=CC=C1C)/C2=CN(C3=CC=CC=C32)C4=CC=CO4

DOS

IR

Vibrations