Geometry & MOs

Info

ID:	76247
PubChem CID:	48424662
Reduced:	F2N2O3C18H18 (1)
Stoich.:	A2B2C3D18E18 (1)
Weight, g/mol:	319.178358
ΔH_f, kcal/mol:	-176.11
Dipole, Da:	4.82
IP(EA), eV:	-9.21(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[2-(cyclopropylmethoxy)propanoylamino]-3-phenylpropanoate

Drug info:

PubChemData

Smile

CN(C1=CC(=C(C=C1)F)F)C(=O)C(CC2=CC=CC=C2)NC(=O)OC

DOS

IR

Vibrations