Geometry & MOs

Info

ID:	198615
PubChem CID:	79125507
Reduced:	NOC19H29 (1)
Stoich.:	ABC19D29 (1)
Weight, g/mol:	281.177964
ΔH_f, kcal/mol:	-70.99
Dipole, Da:	3.17
IP(EA), eV:	-8.99(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(aminomethyl)-2,3-dihydroinden-1-yl]-1-phenylpropan-1-ol

Drug info:

PubChemData

Smile

CCC1CCCC(C1)(CN)C2(CCC3=CC=CC=C3C2)O

DOS

IR

Vibrations