Geometry & MOs

Info

ID:	391799
PubChem CID:	135009686
Reduced:	OPN2H11C15 (1)
Stoich.:	ABC2D11E15 (1)
Weight, g/mol:	405.212406
ΔH_f, kcal/mol:	59.65
Dipole, Da:	2.92
IP(EA), eV:	-8.91(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-1-[(3R,6S)-3,5-dimethyl-6-phenyl-4-(trimethylsilylmethyl)-3,6-dihydrooxazin-2-yl]-3-phenylprop-2-en-1-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2C3=C(C4=CC=CC=C4O2)N=NP3

DOS

IR

Vibrations