Geometry & MOs

Info

ID:	404697
PubChem CID:	135069675
Reduced:	O3C16H22 (1)
Stoich.:	A3B16C22 (1)
Weight, g/mol:	329.118257
ΔH_f, kcal/mol:	-132.52
Dipole, Da:	3.63
IP(EA), eV:	-10.11(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,6R)-9-chloro-7,7,10-trimethyl-16-oxo-10-azatetracyclo[6.6.1.12,6.011,15]hexadeca-1(15),8,11,13-tetraene-2-carbaldehyde

Drug info:

PubChemData

Smile

CCCCOC(=O)C1=C(C(=O)[C@H]2[C@@H]1[C@@H]3CC[C@H]2C3)C

DOS

IR

Vibrations