Geometry & MOs

Info

ID:	390799
PubChem CID:	135000990
Reduced:	SeO3N4C7H10 (1)
Stoich.:	AB3C4D7E10 (1)
Weight, g/mol:	378.25588
ΔH_f, kcal/mol:	-13.37
Dipole, Da:	7.3
IP(EA), eV:	-8.77(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,6-ditert-butyl-4-methylphenyl) (1S,2R)-2-benzylcyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

C1COCCN1C2=NC(=C([Se]2)[N+](=O)[O-])N

DOS

IR

Vibrations