Geometry & MOs

Info

ID:	227342
PubChem CID:	87561377
Reduced:	SSiO7C23H42 (1)
Stoich.:	ABC7D23E42 (1)
Weight, g/mol:	311.142248
ΔH_f, kcal/mol:	-366.87
Dipole, Da:	2.31
IP(EA), eV:	-9.21(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(3-phenyl-1,6-naphthyridin-2-yl)phenyl]methanamine

Drug info:

PubChemData

Smile

CC(C)C[Si](C)(C)OC[C@H]1[C@@H](C[C@H]2[C@@H]1C=CC[C@@H](O2)CCS(=O)(=O)O)OC3CCCCO3

DOS

IR

Vibrations