Geometry & MOs

Info

ID:	171365
PubChem CID:	75367377
Reduced:	ClON3C20H20 (1)
Stoich.:	ABC3D20E20 (1)
Weight, g/mol:	348.158626
ΔH_f, kcal/mol:	32.29
Dipole, Da:	2.69
IP(EA), eV:	-8.59(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-phenyl-3-[[(6S)-3-phenyl-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]urea

Drug info:

PubChemData

Smile

C1[C@@H](OCC2=NC(=CN21)C3=CC=CC=C3)CNCC4=CC=C(C=C4)Cl

DOS

IR

Vibrations