Geometry & MOs

Info

ID:	399884
PubChem CID:	135043466
Reduced:	SiC15H15 (1)
Stoich.:	AB15C15 (1)
Weight, g/mol:	219.125929
ΔH_f, kcal/mol:	120.71
Dipole, Da:	0.6
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.782033
Charge, e:	0

Chem-info

IUPAC name:

methyl (2R,3S,4S)-4-methyl-2-phenylpyrrolidine-3-carboxylate

Drug info:

PubChemData

Smile

C1=CC(C=C1)[Si](C2C=CC=C2)C3C=CC=C3

DOS

IR

Vibrations