Geometry & MOs

Info

ID:	45453
PubChem CID:	10513667
Reduced:	SiO3C11H22 (1)
Stoich.:	AB3C11D22 (1)
Weight, g/mol:	231.089543
ΔH_f, kcal/mol:	-180.04
Dipole, Da:	6.26
IP(EA), eV:	-9.53(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-[4-(2-oxopyrrolidin-1-yl)phenyl]prop-2-enoic acid

Drug info:

PubChemData

Smile

C/C=C/[C@H]([C@H]([C@@H](C)[Si](C)(C)C)C(=O)O)O

DOS

IR

Vibrations