Geometry & MOs

Info

ID:	400799
PubChem CID:	135049141
Reduced:	LiSnC21H21 (1)
Stoich.:	ABC21D21 (1)
Weight, g/mol:	481.082571
ΔH_f, kcal/mol:	143.76
Dipole, Da:	36.67
IP(EA), eV:	-5.2(-2.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R,4S,5S)-5-[(4-methoxyphenyl)methoxy]-4-propan-2-yl-2-(2,2,2-trichloroethanimidoyl)oxyoxan-3-yl] acetate

Drug info:

PubChemData

Smile

[Li].CC1=CC=C(C=C1)[Sn](C2=CC=C(C=C2)C)C3=CC=C(C=C3)C

DOS

IR

Vibrations