Geometry & MOs

Info

ID:	26285
PubChem CID:	643631
Reduced:	NO2C6H11 (2)
Stoich.:	AB2C6D11 (2)
Weight, g/mol:	232.109944
ΔH_f, kcal/mol:	-209.19
Dipole, Da:	4.63
IP(EA), eV:	-9.75(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (E)-3-methoxy-2-[(1S,2S)-2-phenylcyclopropyl]prop-2-enoate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCCCC(=O)NCCC=O

DOS

IR

Vibrations