Geometry & MOs

Info

ID:	148737
PubChem CID:	53788406
Reduced:	NOC18H29 (1)
Stoich.:	ABC18D29 (1)
Weight, g/mol:	245.177964
ΔH_f, kcal/mol:	-43.52
Dipole, Da:	3.96
IP(EA), eV:	-8.74(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-ethyl-9,10-dimethyl-4-azatricyclo[5.4.0.02,6]undeca-1(7),8,10-trien-2-yl)ethanol

Drug info:

PubChemData

Smile

CC.CCN1CC2C3=C(C2(C1)CCO)C=C(C(=C3)C)C

DOS

IR

Vibrations