Geometry & MOs

Info

ID:	228887
PubChem CID:	87566103
Reduced:	O2N3C18H19 (1)
Stoich.:	A2B3C18D19 (1)
Weight, g/mol:	531.09856
ΔH_f, kcal/mol:	18.19
Dipole, Da:	2.73
IP(EA), eV:	-9.12(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[3-bromo-4-[diethoxyphosphoryl(difluoro)methyl]phenyl]ethyl]-N-ethyl-2-phenylacetamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)C(=NC1=CC=CC=C1)N=NC2=CC=CC=C2

DOS

IR

Vibrations