Geometry & MOs

Info

ID:	392700
PubChem CID:	135017699
Reduced:	NO4C9H15 (1)
Stoich.:	AB4C9D15 (1)
Weight, g/mol:	276.281701
ΔH_f, kcal/mol:	-124.49
Dipole, Da:	5.36
IP(EA), eV:	-11.07(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,12S)-1,5,9-trimethyl-12-propan-2-yltricyclo[9.3.0.02,6]tetradecane

Drug info:

PubChemData

Smile

CCOC(=O)C[C@@H]1CCCC1[N+](=O)[O-]

DOS

IR

Vibrations