Geometry & MOs

Info

ID:	48964
PubChem CID:	11528529
Reduced:	NO3C10H17 (1)
Stoich.:	AB3C10D17 (1)
Weight, g/mol:	199.140934
ΔH_f, kcal/mol:	-163.87
Dipole, Da:	6.85
IP(EA), eV:	-10.08(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(9S,10S)-9,10-dideuterio-10-(trideuteriomethyl)-9H-phenanthrene

Drug info:

PubChemData

Smile

CCC(=O)NC1(CCCCC1)C(=O)O

DOS

IR

Vibrations