Geometry & MOs

Info

ID:	137865
PubChem CID:	52274530
Reduced:	N3O4C18H33 (1)
Stoich.:	A3B4C18D33 (1)
Weight, g/mol:	315.187267
ΔH_f, kcal/mol:	-225.17
Dipole, Da:	2.86
IP(EA), eV:	-9.7(0.8)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-methyl-[(1R)-1-(4-methylphenyl)ethyl]azanium

Drug info:

PubChemData

Smile

CCOC(=O)N1CCC(CC1)NC(=O)NCCO[C@@H]2CCCC[C@@H]2C

DOS

IR

Vibrations