Geometry & MOs

Info

ID:	46333
PubChem CID:	10523921
Reduced:	N2Cl3O5H11C13 (1)
Stoich.:	A2B3C5D11E13 (1)
Weight, g/mol:	381.303165
ΔH_f, kcal/mol:	-180.36
Dipole, Da:	4.47
IP(EA), eV:	-10.07(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(6S,8R,11R,12S,16S)-6-(dimethylamino)-7,7,12,16-tetramethyl-15-tetracyclo[9.7.0.03,8.012,16]octadeca-1(18),3,14-trienyl]ethanone

Drug info:

PubChemData

Smile

CCOC(=O)[C@]1(CC(=O)NC1=O)N2C=CC=C2C(=O)C(Cl)(Cl)Cl

DOS

IR

Vibrations