Geometry & MOs

Info

ID:	190035
PubChem CID:	77944060
Reduced:	O4C15H24 (1)
Stoich.:	A4B15C24 (1)
Weight, g/mol:	337.298079
ΔH_f, kcal/mol:	-146.04
Dipole, Da:	2.22
IP(EA), eV:	-7.92(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[heptyl(methyl)amino]-1-(2-hydroxyethyl)-4a-methyl-3,4,5,6,7,8-hexahydro-2H-naphthalen-2-ol

Drug info:

PubChemData

Smile

CC12CCC(C(=C1CCCC23OCCO3)CCO)O

DOS

IR

Vibrations