Geometry & MOs

Info

ID:	188143
PubChem CID:	77673845
Reduced:	N2O2C21H30 (1)
Stoich.:	A2B2C21D30 (1)
Weight, g/mol:	268.203845
ΔH_f, kcal/mol:	-75.44
Dipole, Da:	1.9
IP(EA), eV:	-9.12(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-hydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl) acetate

Drug info:

PubChemData

Smile

C1CC2C(CC1O)C3C(N2)CC(C4C3CNC4)C5=CC=C(C=C5)CO

DOS

IR

Vibrations