Geometry & MOs

Info

ID:	54097
PubChem CID:	14720114
Reduced:	F2N2O3C13H26 (1)
Stoich.:	A2B2C3D13E26 (1)
Weight, g/mol:	510.196628
ΔH_f, kcal/mol:	-284.55
Dipole, Da:	1.19
IP(EA), eV:	-9.7(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 3-[(4-benzamido-2,2-difluoro-3-hydroxy-5-phenylpentyl)amino]-3-oxopropanoate

Drug info:

PubChemData

Smile

CC(C)CC(C(C(CNC(=O)OCC(C)C)(F)F)O)N

DOS

IR

Vibrations