Geometry & MOs

Info

ID:	75849
PubChem CID:	48424064
Reduced:	N2F3O3C20H21 (1)
Stoich.:	A2B3C3D20E21 (1)
Weight, g/mol:	389.145007
ΔH_f, kcal/mol:	-253.29
Dipole, Da:	4.99
IP(EA), eV:	-9.63(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[2-(cyclopropylmethoxy)propanoylamino]-3-[4-(trifluoromethoxy)phenyl]propanoate

Drug info:

PubChemData

Smile

CN(CC1=CC(=CC=C1)C(F)(F)F)C(=O)C(CC2=CC=CC=C2)NC(=O)OC

DOS

IR

Vibrations