Geometry & MOs

Info

ID:	44341
PubChem CID:	10502940
Reduced:	NSi2O3C23H39 (1)
Stoich.:	AB2C3D23E39 (1)
Weight, g/mol:	433.057565
ΔH_f, kcal/mol:	-213.01
Dipole, Da:	3.44
IP(EA), eV:	-8.94(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-1-(2,4-difluorophenyl)-1-[4-[4-(1-methyltetrazol-5-yl)phenyl]-1,3-thiazol-2-yl]ethanol

Drug info:

PubChemData

Smile

C/C=C/[C@H]([C@H]1[C@@H]([C@H](NC1=O)CO[Si](C)(C)C(C)(C)C)[Si](C)(C)C2=CC=CC=C2)O

DOS

IR

Vibrations