Geometry & MOs

Info

ID:	195121
PubChem CID:	78637934
Reduced:	SO2N5C18H25 (1)
Stoich.:	AB2C5D18E25 (1)
Weight, g/mol:	416.17475
ΔH_f, kcal/mol:	-53.52
Dipole, Da:	5.43
IP(EA), eV:	-8.44(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(4-morpholin-4-ylanilino)-1-oxopropan-2-yl] 2-(3-fluoro-4-methoxyphenyl)acetate

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)NC(=O)C(C)SC2=NN=C(N2C)CCC(=O)N

DOS

IR

Vibrations