Geometry & MOs

Info

ID:	43370
PubChem CID:	10321187
Reduced:	FNS2O6C19H22 (1)
Stoich.:	ABC2D6E19F22 (1)
Weight, g/mol:	443.243675
ΔH_f, kcal/mol:	-243.48
Dipole, Da:	6.54
IP(EA), eV:	-8.6(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2S)-3-dimethoxyphosphoryl-2-[[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trienoyl]amino]propanoate

Drug info:

PubChemData

Smile

CCOC(=O)COC1=C(C=C(C=C1)SCCNS(=O)(=O)C2=CC=C(C=C2)OC)F

DOS

IR

Vibrations