Geometry & MOs

Info

ID:	186496
PubChem CID:	77439136
Reduced:	O9C23H24 (1)
Stoich.:	A9B23C24 (1)
Weight, g/mol:	241.142641
ΔH_f, kcal/mol:	-273.65
Dipole, Da:	2.14
IP(EA), eV:	-8.59(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-methyl-3-[methyl-(methylideneamino)amino]prop-2-enoxy]pyrrolidine-2-carboxylic acid

Drug info:

PubChemData

Smile

COC1=C(C2=C(C=C1)C(C(O2)C=CC(=O)OC)C(=O)C3=CC(=C(C(=C3)OC)OC)OC)O

DOS

IR

Vibrations