Geometry & MOs

Info

ID:	311257
PubChem CID:	126590084
Reduced:	N3O9C17H29 (1)
Stoich.:	A3B9C17D29 (1)
Weight, g/mol:	291.186815
ΔH_f, kcal/mol:	-423.18
Dipole, Da:	6.16
IP(EA), eV:	-10.02(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl-prop-1-en-2-ylamino]-2-methylpropane-2-thiol

Drug info:

PubChemData

Smile

CCC(CO)C(=O)NCCCC[C@@H](C(=O)O)NC(=O)N[C@@H](CCC(=O)O)C(=O)O

DOS

IR

Vibrations