Geometry & MOs

Info

ID:	426137
PubChem CID:	135141057
Reduced:	O2F3N3C22H34 (1)
Stoich.:	A2B3C3D22E34 (1)
Weight, g/mol:	428.24975
ΔH_f, kcal/mol:	-256.82
Dipole, Da:	4.0
IP(EA), eV:	-8.92(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,2-dimethylpropyl)-5-[2-[[5-(2,2-dimethylpropyl)furan-3-yl]methyl]-2-methyl-3-(1,3-thiazol-2-yl)propyl]-1,3-oxazole

Drug info:

PubChemData

Smile

CCC(=O)N(CC1(CCOCC1)CCCNCC(C)C)C2=CC=CC(=N2)C(F)(F)F

DOS

IR

Vibrations