Geometry & MOs

Info

ID:	364840
PubChem CID:	127316281
Reduced:	SN2O2C11H18 (1)
Stoich.:	AB2C2D11E18 (1)
Weight, g/mol:	392.134068
ΔH_f, kcal/mol:	-107.15
Dipole, Da:	2.43
IP(EA), eV:	-8.49(0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-(thian-4-ylmethyl)-2-(2,5,6-trimethyl-3-oxopyridazin-4-yl)-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

C1CC(=O)N[C@H]1C(=O)NCC2CCSCC2

DOS

IR

Vibrations