Geometry & MOs

Info

ID:	390668
PubChem CID:	135000257
Reduced:	PN2O4C10H11 (1)
Stoich.:	AB2C4D10E11 (1)
Weight, g/mol:	235.157229
ΔH_f, kcal/mol:	-127.15
Dipole, Da:	2.73
IP(EA), eV:	-9.62(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-(methoxyamino)-5-methyl-1-phenylhexan-3-one

Drug info:

PubChemData

Smile

COP(=O)(C1=CC2=[N+](C=CN=C2C=C1)[O-])OC

DOS

IR

Vibrations