Geometry & MOs

Info

ID:	195032
PubChem CID:	78624981
Reduced:	N3O4C15H21 (1)
Stoich.:	A3B4C15D21 (1)
Weight, g/mol:	361.112564
ΔH_f, kcal/mol:	-144.2
Dipole, Da:	4.18
IP(EA), eV:	-7.61(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-[(3-oxo-1-phenylbutan-2-yl)amino]ethyl] 3,5-difluorobenzoate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1NC(C)C(=O)N2CCNC2=O)OC)OC

DOS

IR

Vibrations