Geometry & MOs

Info

ID:	198616
PubChem CID:	79125508
Reduced:	NOC19H23 (1)
Stoich.:	ABC19D23 (1)
Weight, g/mol:	289.240565
ΔH_f, kcal/mol:	-17.57
Dipole, Da:	3.05
IP(EA), eV:	-8.99(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(aminomethyl)-4-propan-2-ylcyclohexyl]-1-phenylpropan-1-ol

Drug info:

PubChemData

Smile

CCC(C1=CC=CC=C1)(C2(CCC3=CC=CC=C32)CN)O

DOS

IR

Vibrations