Geometry & MOs

Info

ID:	190935
PubChem CID:	78080319
Reduced:	SiO4C19H34 (1)
Stoich.:	AB4C19D34 (1)
Weight, g/mol:	380.155849
ΔH_f, kcal/mol:	-272.03
Dipole, Da:	5.06
IP(EA), eV:	-8.81(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[2-(3-methoxyphenyl)-7-methylsulfanylquinolin-3-yl]methyl]pyrrolidin-3-ol

Drug info:

PubChemData

Smile

CC12CCC(=O)C(C1CCCC2O[Si](C)(C)C(C)(C)C)C(=O)OC

DOS

IR

Vibrations