Geometry & MOs

Info

ID:	166461
PubChem CID:	74692088
Reduced:	FO2N3H13C16 (1)
Stoich.:	AB2C3D13E16 (1)
Weight, g/mol:	264.220164
ΔH_f, kcal/mol:	-24.37
Dipole, Da:	6.54
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.007256
Charge, e:	2

Chem-info

IUPAC name:

ethyl-methyl-(3-morpholin-4-ium-4-yl-3-phenylpropyl)azanium

Drug info:

PubChemData

Smile

CC1=CC=C[NH+]2C1=NC=C(C2=O)NC(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations