Geometry & MOs

Info

ID:	436383
PubChem CID:	135199628
Reduced:	Cl2O7H16C23 (1)
Stoich.:	A2B7C16D23 (1)
Weight, g/mol:	374.241687
ΔH_f, kcal/mol:	-209.01
Dipole, Da:	7.85
IP(EA), eV:	-8.74(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-[2-[2-(6-formamidohexanoylamino)ethoxy]ethoxy]propanoate

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)C3(C4=CC(=C(C(=C4OC5=C(C(=C(C=C53)OC)O)Cl)Cl)O)OC)OC2=O

DOS

IR

Vibrations