Geometry & MOs

Info

ID:	395976
PubChem CID:	135027080
Reduced:	O3N4C17H18 (1)
Stoich.:	A3B4C17D18 (1)
Weight, g/mol:	268.109944
ΔH_f, kcal/mol:	-54.78
Dipole, Da:	3.28
IP(EA), eV:	-8.8(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-methoxy-2-(2-methyloxiran-2-yl)phenyl]-phenylmethanone

Drug info:

PubChemData

Smile

CCN(C1=CC2=C(C=C1)NC(=O)[C@@]23CC3C4=CN=CN4)C(=O)OC

DOS

IR

Vibrations