Geometry & MOs

Info

ID:	315230
PubChem CID:	126625158
Reduced:	ClO2N5C15H22 (1)
Stoich.:	AB2C5D15E22 (1)
Weight, g/mol:	405.13334
ΔH_f, kcal/mol:	-47.76
Dipole, Da:	3.7
IP(EA), eV:	-9.08(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-phenyl-2-[1-[4-(2-propan-2-yl-1,3-thiazol-5-yl)pyridin-2-yl]propan-2-yl]-1,3-thiazole

Drug info:

PubChemData

Smile

CN(C)C/C=C/C(=O)N1CCC(CC1)OC2=NC=NC(=C2Cl)N

DOS

IR

Vibrations