Geometry & MOs

Info

ID:	395478
PubChem CID:	135025551
Reduced:	OC14H16 (1)
Stoich.:	AB14C16 (1)
Weight, g/mol:	623.288303
ΔH_f, kcal/mol:	-19.99
Dipole, Da:	3.53
IP(EA), eV:	-9.57(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (Z)-3-[[(2S,3R,4R,5S,6S)-2,4,5,6-tetrakis(phenylmethoxy)oxan-3-yl]amino]prop-2-enoate

Drug info:

PubChemData

Smile

C[C@H]\1CCCC(=O)/C1=C/C2=CC=CC=C2

DOS

IR

Vibrations