Geometry & MOs

Info

ID:	297896
PubChem CID:	117636417
Reduced:	ClF3N5O5H19C23 (1)
Stoich.:	AB3C5D5E19F23 (1)
Weight, g/mol:	147.044916
ΔH_f, kcal/mol:	-192.1
Dipole, Da:	5.77
IP(EA), eV:	-8.99(-1.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[dimethoxy(methylidene)-lambda5-phosphanyl]acetonitrile

Drug info:

PubChemData

Smile

CC(C)(C1=CC(=NO1)NC(=O)NC2=CC(=CC=C2)OC3=NC=NC4=CC(=C(C=C43)OC)OCl)C(F)(F)F

DOS

IR

Vibrations