Geometry & MOs

Info

ID:	381872
PubChem CID:	134972730
Reduced:	NOC20H21 (1)
Stoich.:	ABC20D21 (1)
Weight, g/mol:	229.146664
ΔH_f, kcal/mol:	43.27
Dipole, Da:	3.34
IP(EA), eV:	-8.82(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,6,6-trimethyl-3-(2-phenylethenyl)-4,5-dihydrooxazine

Drug info:

PubChemData

Smile

CC1(CC(C(=NO1)C=CC2=CC=CC=C2)C3=CC=CC=C3)C

DOS

IR

Vibrations