Geometry & MOs

Info

ID:	198613
PubChem CID:	79125370
Reduced:	NO2C13H27 (1)
Stoich.:	AB2C13D27 (1)
Weight, g/mol:	287.224915
ΔH_f, kcal/mol:	-134.47
Dipole, Da:	0.56
IP(EA), eV:	-9.18(2.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(aminomethyl)-4-ethylcyclohexyl]-3,4-dihydro-1H-naphthalen-2-ol

Drug info:

PubChemData

Smile

CCC1(CC(CCO1)(C(C)(CC)CN)O)C

DOS

IR

Vibrations