Geometry & MOs

Info

ID:	195852
PubChem CID:	78743200
Reduced:	SF2N2O5C14H18 (1)
Stoich.:	AB2C2D5E14F18 (1)
Weight, g/mol:	368.233802
ΔH_f, kcal/mol:	-287.8
Dipole, Da:	5.43
IP(EA), eV:	-10.12(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[(4-methylphenyl)-phenylmethyl]-[2-oxo-2-[[1-oxo-1-(propylamino)propan-2-yl]amino]ethyl]azanium

Drug info:

PubChemData

Smile

CCNC(=O)C(C)OC(=O)CCNS(=O)(=O)C1=CC(=C(C=C1)F)F

DOS

IR

Vibrations