Geometry & MOs

Info

ID:	395311
PubChem CID:	135025175
Reduced:	NSO3C26H27 (1)
Stoich.:	ABC3D26E27 (1)
Weight, g/mol:	156.078644
ΔH_f, kcal/mol:	-44.78
Dipole, Da:	5.06
IP(EA), eV:	-9.04(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (E)-3-[(2S,3S)-3-ethyloxiran-2-yl]prop-2-enoate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)[C@@H]2C[C@@H](N(C(O2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C)C=C

DOS

IR

Vibrations