Geometry & MOs

Info

ID:	170948
PubChem CID:	75305046
Reduced:	Si2O6C33H48 (1)
Stoich.:	A2B6C33D48 (1)
Weight, g/mol:	421.099788
ΔH_f, kcal/mol:	-318.44
Dipole, Da:	5.01
IP(EA), eV:	-8.17(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-nitro-6-[[5-[4-(trifluoromethyl)phenyl]pyrimidin-2-yl]methoxy]-6,7-dihydro-5H-imidazo[2,1-b][1,3]oxazine

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OC1C2C(C(C3=CC=CC=C13)O[Si](C)(C)C(C)(C)C)C(=O)OC2=CCOC4=CC=C(C=C4)OC

DOS

IR

Vibrations