Geometry & MOs

Info

ID:	349764
PubChem CID:	127276156
Reduced:	N3O3C18H31 (1)
Stoich.:	A3B3C18D31 (1)
Weight, g/mol:	350.085577
ΔH_f, kcal/mol:	-172.6
Dipole, Da:	3.62
IP(EA), eV:	-9.4(0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-(4-chlorophenyl)-5-methyl-1,3-thiazol-2-yl]methyl]oxane-3-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)NC(=O)NC2CCN(CC2)C(=O)C3CCCOC3

DOS

IR

Vibrations