Geometry & MOs

Info

ID:	36850
PubChem CID:	8013748
Reduced:	FNO6C22H26 (1)
Stoich.:	ABC6D22E26 (1)
Weight, g/mol:	408.108814
ΔH_f, kcal/mol:	-260.57
Dipole, Da:	2.75
IP(EA), eV:	-8.9(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-[(5-chloropyridin-2-yl)amino]-1-oxopropan-2-yl] 2-(3,4,5-trimethoxyphenyl)acetate

Drug info:

PubChemData

Smile

C[C@H](C(=O)NCCC1=CC=C(C=C1)F)OC(=O)CC2=CC(=C(C(=C2)OC)OC)OC

DOS

IR

Vibrations