Geometry & MOs

Info

ID:	198695
PubChem CID:	79137966
Reduced:	NOC15H23 (1)
Stoich.:	ABC15D23 (1)
Weight, g/mol:	283.287515
ΔH_f, kcal/mol:	-58.98
Dipole, Da:	1.71
IP(EA), eV:	-9.04(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)C(C2(CCCC2)CN)O

DOS

IR

Vibrations