Geometry & MOs

Info

ID:	176106
PubChem CID:	75997910
Reduced:	ClO2N3C7H10 (1)
Stoich.:	AB2C3D7E10 (1)
Weight, g/mol:	415.144964
ΔH_f, kcal/mol:	-14.86
Dipole, Da:	7.99
IP(EA), eV:	-9.13(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-diphenylphosphanyl-3-propan-2-yloxadiazol-3-ium-5-yl)benzenecarboximidate

Drug info:

PubChemData

Smile

CC[N+]1=NOC(=C1CCl)N=C(C)[O-]

DOS

IR

Vibrations