Geometry & MOs

Info

ID:	144593
PubChem CID:	53387438
Reduced:	NC6H10 (2)
Stoich.:	AB6C10 (2)
Weight, g/mol:	349.094806
ΔH_f, kcal/mol:	1.22
Dipole, Da:	2.24
IP(EA), eV:	-9.03(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R,5R,7aS)-3,5-bis(4-fluorophenyl)-1,3,5,7-tetrahydro-[1,3]thiazolo[3,4-c][1,3]oxazol-7a-yl]methanol

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(CCN)CCN

DOS

IR

Vibrations