Geometry & MOs

Info

ID:	412601
PubChem CID:	135085498
Reduced:	NOC16H27 (1)
Stoich.:	ABC16D27 (1)
Weight, g/mol:	798.25297
ΔH_f, kcal/mol:	-17.34
Dipole, Da:	3.48
IP(EA), eV:	-9.15(0.52)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

zinc;ethane;[[1-[[2-hydroxy-3-[[2-[hydroxy(diphenyl)methyl]pyrrolidin-1-yl]methyl]-5-methylphenyl]methyl]pyrrolidin-2-yl]-diphenylmethyl]oxidanium;zinc

Drug info:

PubChemData

Smile

C[C@H]1[C@H](N1CC2C=CC=C2)C(C(C)C)(C(C)C)O

DOS

IR

Vibrations