Geometry & MOs

Info

ID:	176107
PubChem CID:	75998185
Reduced:	PO2N3H22C24 (1)
Stoich.:	AB2C3D22E24 (1)
Weight, g/mol:	282.132805
ΔH_f, kcal/mol:	66.62
Dipole, Da:	5.82
IP(EA), eV:	-8.69(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[cyclopropyl(hydroxy)methyl]-3-morpholin-4-yloxadiazol-3-ium-5-yl]ethanimidate

Drug info:

PubChemData

Smile

CC(C)[N+]1=NOC(=C1P(C2=CC=CC=C2)C3=CC=CC=C3)N=C(C4=CC=CC=C4)[O-]

DOS

IR

Vibrations