Geometry & MOs

Info

ID:	39132
PubChem CID:	8139758
Reduced:	ClFON2C18H20 (1)
Stoich.:	ABCD2E18F20 (1)
Weight, g/mol:	390.215472
ΔH_f, kcal/mol:	-56.94
Dipole, Da:	5.12
IP(EA), eV:	-9.11(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]-2-oxoethyl] 3-(4-tert-butylphenoxy)propanoate

Drug info:

PubChemData

Smile

CN(C)CC1=CC=CC=C1CNC(=O)CC2=C(C=CC=C2Cl)F

DOS

IR

Vibrations