Geometry & MOs

Info

ID:	390328
PubChem CID:	134998534
Reduced:	OPN2H19C21 (1)
Stoich.:	ABC2D19E21 (1)
Weight, g/mol:	364.114078
ΔH_f, kcal/mol:	43.87
Dipole, Da:	6.07
IP(EA), eV:	-9.82(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-N-diphenylphosphoryl-1-(4-fluorophenyl)-1-isocyanoethanamine

Drug info:

PubChemData

Smile

C[C@](C1=CC=CC=C1)(NP(=O)(C2=CC=CC=C2)C3=CC=CC=C3)[N+]#[C-]

DOS

IR

Vibrations