Geometry & MOs

Info

ID:	198614
PubChem CID:	79125506
Reduced:	NOC19H29 (1)
Stoich.:	ABC19D29 (1)
Weight, g/mol:	287.224915
ΔH_f, kcal/mol:	-66.59
Dipole, Da:	1.32
IP(EA), eV:	-9.18(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1CCC(CC1)(CN)C2(CCC3=CC=CC=C3C2)O

DOS

IR

Vibrations