Geometry & MOs

Info

ID:	149657
PubChem CID:	53789331
Reduced:	O8C13H18 (1)
Stoich.:	A8B13C18 (1)
Weight, g/mol:	234.115698
ΔH_f, kcal/mol:	-344.87
Dipole, Da:	3.6
IP(EA), eV:	-10.9(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

phenyl(quinolin-2-yl)methanamine

Drug info:

PubChemData

Smile

COC(=O)[C@@H]1CC(C([C@@H]1C(=O)OC)C(=O)OC)C(=O)OC

DOS

IR

Vibrations